2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine

C71H167N15O18 — CID 159010819

IUPAC2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine
SMILESCC(C)NO.CC(N)CO.CN1CCCC(O)C1.CN1CCCCC1CO.NCCCO.NCCO.NNCCO.OC1CCCNC1.OCC(O)CN1CCCCC1.OCC(O)CN1CCOCC1.OCC1CCCCN1.OCCN1CCCCC1.OCCN1CCOCC1.ONC1CCCCC1
InChIInChI=1S/C8H17NO2.C7H15NO3.2C7H15NO.C6H13NO2.3C6H13NO.C5H11NO.3C3H9NO.C2H8N2O.C2H7NO/c10-7-8(11)6-9-4-2-1-3-5-9;9-6-7(10)5-8-1-3-11-4-2-8;1-8-5-3-2-4-7(8)6-9;9-7-6-8-4-2-1-3-5-8;8-4-1-7-2-5-9-6-3-7;1-7-4-2-3-6(8)5-7;8-5-6-3-1-2-4-7-6;8-7-6-4-2-1-3-5-6;7-5-2-1-3-6-4-5;1-3(2)4-5;1-3(4)2-5;4-2-1-3-5;3-4-1-2-5;3-1-2-4/h8,10-11H,1-7H2;7,9-10H,1-6H2;7,9H,2-6H2,1H3;9H,1-7H2;8H,1-6H2;6,8H,2-5H2,1H3;2*6-8H,1-5H2;5-7H,1-4H2;3-5H,1-2H3;3,5H,2,4H2,1H3;5H,1-4H2;4-5H,1-3H2;4H,1-3H2
InChIKeyJSLRGYLVJCXKQI-UHFFFAOYSA-N
MW1519.20 g/mol
LogP-3.64
Rot. Bonds20

About 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine

2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine (PubChem CID 159010819) has the molecular formula C71H167N15O18 and a molecular weight of 1519.20 g/mol. Its IUPAC name is 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine.

Molecular Properties

Compound Name2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine
PubChem CID159010819
Molecular FormulaC71H167N15O18
Molecular Weight1519.20 g/mol
Exact Mass1518.26
IUPAC Name2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine
SMILESCC(C)NO.CC(N)CO.CN1CCCC(O)C1.CN1CCCCC1CO.NCCCO.NCCO.NNCCO.OC1CCCNC1.OCC(O)CN1CCCCC1.OCC(O)CN1CCOCC1.OCC1CCCCN1.OCCN1CCCCC1.OCCN1CCOCC1.ONC1CCCCC1
InChIInChI=1S/C8H17NO2.C7H15NO3.2C7H15NO.C6H13NO2.3C6H13NO.C5H11NO.3C3H9NO.C2H8N2O.C2H7NO/c10-7-8(11)6-9-4-2-1-3-5-9;9-6-7(10)5-8-1-3-11-4-2-8;1-8-5-3-2-4-7(8)6-9;9-7-6-8-4-2-1-3-5-8;8-4-1-7-2-5-9-6-3-7;1-7-4-2-3-6(8)5-7;8-5-6-3-1-2-4-7-6;8-7-6-4-2-1-3-5-6;7-5-2-1-3-6-4-5;1-3(2)4-5;1-3(4)2-5;4-2-1-3-5;3-4-1-2-5;3-1-2-4/h8,10-11H,1-7H2;7,9-10H,1-6H2;7,9H,2-6H2,1H3;9H,1-7H2;8H,1-6H2;6,8H,2-5H2,1H3;2*6-8H,1-5H2;5-7H,1-4H2;3-5H,1-2H3;3,5H,2,4H2,1H3;5H,1-4H2;4-5H,1-3H2;4H,1-3H2
InChIKeyJSLRGYLVJCXKQI-UHFFFAOYSA-N
XLogP-3.64
TPSA525.81 Ų
H-Bond Donors25
H-Bond Acceptors33
Rotatable Bonds20
Heavy Atoms104
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001519.20
LogP ≤ 5-3.64
H-Bond Donors ≤ 525
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine?
The IUPAC name of 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine (CID 159010819) is 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine.
What is the SMILES notation for 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine?
The canonical SMILES for 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine is CC(C)NO.CC(N)CO.CN1CCCC(O)C1.CN1CCCCC1CO.NCCCO.NCCO.NNCCO.OC1CCCNC1.OCC(O)CN1CCCCC1.OCC(O)CN1CCOCC1.OCC1CCCCN1.OCCN1CCCCC1.OCCN1CCOCC1.ONC1CCCCC1.
What is the InChIKey of 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine?
The InChIKey is JSLRGYLVJCXKQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2.C7H15NO3.2C7H15NO.C6H13NO2.3C6H13NO.C5H11NO.3C3H9NO.C2H8N2O.C2H7NO/c10-7-8(11)6-9-4-2-1-3-5-9;9-6-7(10)5-8-1-3-11-4-2-8;1-8-5-3-2-4-7(8)6-9;9-7-6-8-4-2-1-3-5-8;8-4-1-7-2-5-9-6-3-7;1-7-4-2-3-6(8)5-7;8-5-6-3-1-2-4-7-6;8-7-6-4-2-1-3-5-6;7-5-2-1-3-6-4-5;1-3(2)4-5;1-3(4)2-5;4-2-1-3-5;3-4-1-2-5;3-1-2-4/h8,10-11H,1-7H2;7,9-10H,1-6H2;7,9H,2-6H2,1H3;9H,1-7H2;8H,1-6H2;6,8H,2-5H2,1H3;2*6-8H,1-5H2;5-7H,1-4H2;3-5H,1-2H3;3,5H,2,4H2,1H3;5H,1-4H2;4-5H,1-3H2;4H,1-3H2.
What are the key properties of 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine?
2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine has a molecular weight of 1519.20 g/mol, XLogP of -3.64, 20 rotatable bonds, 25 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;2-aminopropan-1-ol;3-aminopropan-1-ol;N-cyclohexylhydroxylamine;2-hydrazinylethanol;1-methylpiperidin-3-ol;(1-methylpiperidin-2-yl)methanol;2-morpholin-4-ylethanol;3-morpholin-4-ylpropane-1,2-diol;piperidin-3-ol;2-piperidin-1-ylethanol;piperidin-2-ylmethanol;3-piperidin-1-ylpropane-1,2-diol;N-propan-2-ylhydroxylamine is sourced from PubChem (CID 159010819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).