(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide

C12H22N2O2 — CID 104969411

IUPAC(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide
SMILESO=C(NCC1(CCO)CC1)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c15-7-5-12(3-4-12)9-14-11(16)10-2-1-6-13-8-10/h10,13,15H,1-9H2,(H,14,16)/t10-/m1/s1
InChIKeyDMVCRXWTUZBROU-SNVBAGLBSA-N
MW226.32 g/mol
LogP0.26
Rot. Bonds5

About (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide

(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide (PubChem CID 104969411) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide
PubChem CID104969411
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide
SMILESO=C(NCC1(CCO)CC1)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c15-7-5-12(3-4-12)9-14-11(16)10-2-1-6-13-8-10/h10,13,15H,1-9H2,(H,14,16)/t10-/m1/s1
InChIKeyDMVCRXWTUZBROU-SNVBAGLBSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethylcyclopentyl)methyl]piperidine-3-carboxamide
CID 103797871
N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]piperidine-3-carboxamide
CID 119339952
2-[1-[[[(3S)-piperidine-3-carbonyl]amino]methyl]cyclobutyl]acetic acid
CID 81161187
(3R)-N-[(1-hydroxycyclobutyl)methyl]piperidine-3-carboxamide
CID 104874196
N-[[1-(hydroxymethyl)cyclohexyl]methyl]pyrrolidine-3-carboxamide
CID 112701948
1-[[[(3R)-piperidine-3-carbonyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 113311227
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
(3R)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]piperidine-3-carboxamide
CID 81133718
N-[(1-ethylcyclobutyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119782174
N-[[1-(2-methoxyethyl)cyclobutyl]methyl]pyrrolidine-3-carboxamide
CID 119820405
2-[1-[(piperidin-3-ylamino)methyl]cyclopropyl]ethanol
CID 114756019
N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]piperidine-3-carboxamide
CID 119896432

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide (CID 104969411) is (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide is O=C(NCC1(CCO)CC1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide?
The InChIKey is DMVCRXWTUZBROU-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-7-5-12(3-4-12)9-14-11(16)10-2-1-6-13-8-10/h10,13,15H,1-9H2,(H,14,16)/t10-/m1/s1.
What are the key properties of (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide?
(3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]piperidine-3-carboxamide is sourced from PubChem (CID 104969411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).