(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide

C17H23N3O3 — CID 94170855

IUPAC(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
SMILESO=C1CC[C@@H](C(=O)NCc2ccnc(OC3CCCC3)c2)CN1
InChIInChI=1S/C17H23N3O3/c21-15-6-5-13(11-19-15)17(22)20-10-12-7-8-18-16(9-12)23-14-3-1-2-4-14/h7-9,13-14H,1-6,10-11H2,(H,19,21)(H,20,22)/t13-/m1/s1
InChIKeyVRVWSSNCGWGUOL-CYBMUJFWSA-N
MW317.39 g/mol
LogP1.55
Rot. Bonds5

About (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide

(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide (PubChem CID 94170855) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
PubChem CID94170855
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
SMILESO=C1CC[C@@H](C(=O)NCc2ccnc(OC3CCCC3)c2)CN1
InChIInChI=1S/C17H23N3O3/c21-15-6-5-13(11-19-15)17(22)20-10-12-7-8-18-16(9-12)23-14-3-1-2-4-14/h7-9,13-14H,1-6,10-11H2,(H,19,21)(H,20,22)/t13-/m1/s1
InChIKeyVRVWSSNCGWGUOL-CYBMUJFWSA-N
XLogP1.55
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[(2-cyclohexyloxy-4-pyridinyl)methyl]oxolane-2-carboxamide
CID 94801440
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 55679309
N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide
CID 120704184
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 55659546
5-[(2-cyclohexyloxy-4-pyridinyl)methylcarbamoyl]pyrazine-2-carboxylic acid
CID 120690264
N-[(3-chlorophenyl)methyl]-6-oxopiperidine-3-carboxamide
CID 112728690
N-[(6-methyl-3-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 113223600
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 112821587
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 55659080
(3S)-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-ylmethyl)-6-oxopiperidine-3-carboxamide
CID 126443586
(2S,4S)-2-methyl-N-[[2-(4-methylcyclohexyl)oxy-4-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120636780
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]pyrazine-2-carboxamide
CID 53499351

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide?
The IUPAC name of (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide (CID 94170855) is (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide is O=C1CC[C@@H](C(=O)NCc2ccnc(OC3CCCC3)c2)CN1.
What is the InChIKey of (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide?
The InChIKey is VRVWSSNCGWGUOL-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H23N3O3/c21-15-6-5-13(11-19-15)17(22)20-10-12-7-8-18-16(9-12)23-14-3-1-2-4-14/h7-9,13-14H,1-6,10-11H2,(H,19,21)(H,20,22)/t13-/m1/s1.
What are the key properties of (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide?
(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 94170855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).