1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol

C10H22N2O — CID 64818768

IUPAC1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol
SMILESCC1CCCCN1CC(C)(O)CN
InChIInChI=1S/C10H22N2O/c1-9-5-3-4-6-12(9)8-10(2,13)7-11/h9,13H,3-8,11H2,1-2H3
InChIKeyWJAKCSGURCKGED-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.57
Rot. Bonds3

About 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol

1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol (PubChem CID 64818768) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol
PubChem CID64818768
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol
SMILESCC1CCCCN1CC(C)(O)CN
InChIInChI=1S/C10H22N2O/c1-9-5-3-4-6-12(9)8-10(2,13)7-11/h9,13H,3-8,11H2,1-2H3
InChIKeyWJAKCSGURCKGED-UHFFFAOYSA-N
XLogP0.57
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2-methyl-3-(2-methylpyrrolidin-1-yl)propan-2-ol
CID 64818955
1-amino-2-methyl-6-(2-methylpiperidin-1-yl)hexan-2-ol
CID 64818983
2-methyl-3-(2-methylpyrrolidin-1-yl)propane-1,2-diol
CID 104550406
1-amino-2-methyl-3-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propan-2-ol
CID 79924930
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-3-amino-2-methylpropan-2-ol
CID 102728937
2-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-1-ol
CID 64795621
[1-hydroxy-2-(2-methylpiperidin-1-yl)-1-phosphonoethyl]phosphonic acid
CID 22406539
1,1,1-trifluoro-2-methyl-3-(2-methylpyrrolidin-1-yl)propan-2-ol
CID 130487919
3-[(2-methylazepan-1-yl)methyl]pentan-3-amine
CID 79813474
(2-methylpiperidin-1-yl)methanol
CID 67262865
2-methyl-2-[(2-methylpiperidin-1-yl)methyl]pentanoic acid
CID 62272835
ethanol;(2S)-1-ethyl-2-methylpiperidine
CID 170618464

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol (CID 64818768) is 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol is CC1CCCCN1CC(C)(O)CN.
What is the InChIKey of 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol?
The InChIKey is WJAKCSGURCKGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9-5-3-4-6-12(9)8-10(2,13)7-11/h9,13H,3-8,11H2,1-2H3.
What are the key properties of 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol?
1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol has a molecular weight of 186.30 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-3-(2-methylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 64818768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).