2-[3-(aminomethyl)piperidin-1-yl]ethanol

C8H18N2O — CID 6484147

IUPAC2-[3-(aminomethyl)piperidin-1-yl]ethanol
SMILESNCC1CCCN(CCO)C1
InChIInChI=1S/C8H18N2O/c9-6-8-2-1-3-10(7-8)4-5-11/h8,11H,1-7,9H2
InChIKeyMCPMDMYEWWAVSD-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.35
Rot. Bonds3

About 2-[3-(aminomethyl)piperidin-1-yl]ethanol

2-[3-(aminomethyl)piperidin-1-yl]ethanol (PubChem CID 6484147) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-[3-(aminomethyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-(aminomethyl)piperidin-1-yl]ethanol
PubChem CID6484147
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-[3-(aminomethyl)piperidin-1-yl]ethanol
SMILESNCC1CCCN(CCO)C1
InChIInChI=1S/C8H18N2O/c9-6-8-2-1-3-10(7-8)4-5-11/h8,11H,1-7,9H2
InChIKeyMCPMDMYEWWAVSD-UHFFFAOYSA-N
XLogP-0.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Amino-3-(3-methylpiperidin-1-yl)propan-2-ol
CID 3161650
2-[4-(Aminomethyl)piperidin-1-yl]ethan-1-ol
CID 7330476
1-Amino-3-(piperidin-1-yl)propan-2-ol
CID 12174992
2-(4-Aminopiperidin-1-yl)ethan-1-ol
CID 15733445
2-(4-((Methylamino)methyl)piperidin-1-yl)ethan-1-ol
CID 28063525
1-(Ethylamino)-3-(4-methyl-1-piperidinyl)-2-propanol
CID 2836730
1-[1-(2-Methoxyethyl)piperidin-3-YL]-N-methylmethanamine
CID 43811472
2-(1,2,5-Trimethyl-piperidin-4-ylamino)-butan-1-ol
CID 6486630
2-[3,3-Difluoro-5-methyl-4-(methylamino)piperidin-1-yl]ethanol;ethane
CID 169135144
1-[(Piperidin-3-yl)methyl]pyrrolidin-3-ol
CID 56831533
1,1,1-Trifluoro-3-[3-(methylaminomethyl)piperidin-1-yl]propan-2-ol
CID 63899252
3-[3-(Ethylaminomethyl)piperidin-1-yl]-1,1,1-trifluoropropan-2-ol
CID 63899271

Frequently Asked Questions

What is the IUPAC name of 2-[3-(aminomethyl)piperidin-1-yl]ethanol?
The IUPAC name of 2-[3-(aminomethyl)piperidin-1-yl]ethanol (CID 6484147) is 2-[3-(aminomethyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-(aminomethyl)piperidin-1-yl]ethanol?
The canonical SMILES for 2-[3-(aminomethyl)piperidin-1-yl]ethanol is NCC1CCCN(CCO)C1.
What is the InChIKey of 2-[3-(aminomethyl)piperidin-1-yl]ethanol?
The InChIKey is MCPMDMYEWWAVSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c9-6-8-2-1-3-10(7-8)4-5-11/h8,11H,1-7,9H2.
What are the key properties of 2-[3-(aminomethyl)piperidin-1-yl]ethanol?
2-[3-(aminomethyl)piperidin-1-yl]ethanol has a molecular weight of 158.24 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(aminomethyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 6484147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).