2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol

C9H20N2O — CID 66565626

IUPAC2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol
SMILESCN1CCC[C@@H](N(C)CCO)C1
InChIInChI=1S/C9H20N2O/c1-10-5-3-4-9(8-10)11(2)6-7-12/h9,12H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyUODDPEKPHVJCRC-SECBINFHSA-N
MW172.27 g/mol
LogP0.00
Rot. Bonds3

About 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol

2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol (PubChem CID 66565626) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol
PubChem CID66565626
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol
SMILESCN1CCC[C@@H](N(C)CCO)C1
InChIInChI=1S/C9H20N2O/c1-10-5-3-4-9(8-10)11(2)6-7-12/h9,12H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyUODDPEKPHVJCRC-SECBINFHSA-N
XLogP0.00
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-methyl-N'-(1-methylpiperidin-3-yl)propane-1,3-diamine
CID 62545866
2-[[(3S)-1-methylpiperidin-3-yl]-propan-2-ylamino]ethanol
CID 66565655
N-hexyl-N,1-dimethylpiperidin-3-amine
CID 71906386
N-[2-(4-aminopiperidin-1-yl)ethyl]-N,1-dimethylpiperidin-3-amine
CID 79327766
9-[methyl-(1-methylpiperidin-3-yl)amino]nonane-1-thiol
CID 105343956
4-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propylamino)butan-1-ol
CID 64787609
2-[2-[methyl-(1-methylpiperidin-3-yl)amino]ethyl]cyclopentan-1-one
CID 79569765
N-(methoxymethyl)-N,1-dimethylpiperidin-3-amine
CID 115258466
N-(2-bromoprop-2-enyl)-N,1-dimethylpiperidin-3-amine
CID 130650445
N'-methyl-N'-(1-methylpiperidin-3-yl)-N-(2-methylpropyl)propane-1,3-diamine
CID 62547703
2-amino-2-methyl-4-[methyl-(1-methylpiperidin-3-yl)amino]butanamide
CID 62545950
N'-hydroxy-5-[methyl-(1-methylpiperidin-3-yl)amino]pentanimidamide
CID 55084848

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol?
The IUPAC name of 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol (CID 66565626) is 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol?
The canonical SMILES for 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol is CN1CCC[C@@H](N(C)CCO)C1.
What is the InChIKey of 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol?
The InChIKey is UODDPEKPHVJCRC-SECBINFHSA-N. The full InChI is InChI=1S/C9H20N2O/c1-10-5-3-4-9(8-10)11(2)6-7-12/h9,12H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol?
2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol has a molecular weight of 172.27 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol is sourced from PubChem (CID 66565626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).