(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide

C18H29N3O3 — CID 128683899

IUPAC(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide
SMILESCCc1noc(C)c1CNC(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1
InChIInChI=1S/C18H29N3O3/c1-3-16-14(12(2)24-20-16)10-19-18(23)21-9-8-17(22)15(11-21)13-6-4-5-7-13/h13,15,17,22H,3-11H2,1-2H3,(H,19,23)/t15-,17+/m0/s1
InChIKeyRSOICNKFKKEJCG-DOTOQJQBSA-N
MW335.45 g/mol
LogP2.63
Rot. Bonds4

About (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide

(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide (PubChem CID 128683899) has the molecular formula C18H29N3O3 and a molecular weight of 335.45 g/mol. Its IUPAC name is (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide.

Molecular Properties

Compound Name(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide
PubChem CID128683899
Molecular FormulaC18H29N3O3
Molecular Weight335.45 g/mol
Exact Mass335.22
IUPAC Name(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide
SMILESCCc1noc(C)c1CNC(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1
InChIInChI=1S/C18H29N3O3/c1-3-16-14(12(2)24-20-16)10-19-18(23)21-9-8-17(22)15(11-21)13-6-4-5-7-13/h13,15,17,22H,3-11H2,1-2H3,(H,19,23)/t15-,17+/m0/s1
InChIKeyRSOICNKFKKEJCG-DOTOQJQBSA-N
XLogP2.63
TPSA78.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methylcarbamoyl]piperidine-3-carboxylic acid
CID 122015374
(3S,4S)-3-cyclopentyl-4-hydroxy-N-[(3-methylfuran-2-yl)methyl]piperidine-1-carboxamide
CID 164637886
(3S,4S)-1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methylcarbamoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122015376
(3R,4R)-3-cyclopentyl-N-[(1-ethylpyrazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide
CID 128682443
N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-5-oxa-8-azaspiro[2.6]nonane-8-carboxamide
CID 128683883
(2R)-2-cyclohexyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrrolidine-1-carboxamide
CID 97314346
(3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-hydroxypiperidin-1-yl)methanone
CID 43416021
3-cyclopropyl-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]piperidine-1-carboxamide
CID 126806353
1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]pyrrolidine-2-carboxylic acid
CID 119909283
(2S)-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-2-(difluoromethyl)pyrrolidine-1-carboxamide
CID 138010131
[(3S,4S)-3-cyclopentyl-4-hydroxypiperidin-1-yl]-(2-cyclopropyl-6-methyl-3-pyridinyl)methanone
CID 164629456
(3-ethyl-5-methyl-1,2-oxazol-4-yl)-[3-(methylamino)pyrrolidin-1-yl]methanone;hydrochloride
CID 75513671

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide?
The IUPAC name of (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide (CID 128683899) is (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide.
What is the SMILES notation for (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide?
The canonical SMILES for (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide is CCc1noc(C)c1CNC(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1.
What is the InChIKey of (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide?
The InChIKey is RSOICNKFKKEJCG-DOTOQJQBSA-N. The full InChI is InChI=1S/C18H29N3O3/c1-3-16-14(12(2)24-20-16)10-19-18(23)21-9-8-17(22)15(11-21)13-6-4-5-7-13/h13,15,17,22H,3-11H2,1-2H3,(H,19,23)/t15-,17+/m0/s1.
What are the key properties of (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide?
(3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-3-cyclopentyl-N-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)methyl]-4-hydroxypiperidine-1-carboxamide is sourced from PubChem (CID 128683899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).