(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide

C15H23N3O3 — CID 97087871

IUPAC(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
SMILESCC(=O)N[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccco2)C1
InChIInChI=1S/C15H23N3O3/c1-11(9-14-6-4-8-21-14)16-15(20)18-7-3-5-13(10-18)17-12(2)19/h4,6,8,11,13H,3,5,7,9-10H2,1-2H3,(H,16,20)(H,17,19)/t11-,13+/m0/s1
InChIKeyMNZHVKZJDXHVGB-WCQYABFASA-N
MW293.37 g/mol
LogP1.52
Rot. Bonds4

About (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide

(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide (PubChem CID 97087871) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
PubChem CID97087871
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
SMILESCC(=O)N[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccco2)C1
InChIInChI=1S/C15H23N3O3/c1-11(9-14-6-4-8-21-14)16-15(20)18-7-3-5-13(10-18)17-12(2)19/h4,6,8,11,13H,3,5,7,9-10H2,1-2H3,(H,16,20)(H,17,19)/t11-,13+/m0/s1
InChIKeyMNZHVKZJDXHVGB-WCQYABFASA-N
XLogP1.52
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-acetamido-N-[1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 71893038
(3R)-1-[4-(furan-2-yl)butan-2-ylcarbamoyl]piperidine-3-carboxylic acid
CID 81128264
N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
CID 95383461
2-[1-[1-(furan-2-yl)propan-2-ylcarbamoyl]azetidin-3-yl]propanoic acid
CID 116683044
N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide
CID 121084182
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide
CID 96554428
N-[(2S)-1-(furan-2-yl)propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 35684027
(3S)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97227310
(3R)-3-acetamido-N-[(1R)-1-pyridin-2-ylethyl]piperidine-1-carboxamide
CID 95152686
(3R)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-methylsulfonylpiperidine-3-carboxamide
CID 94022233
1-[[1-(furan-2-yl)-4-methoxybutan-2-yl]carbamoyl]piperidine-3-carboxylic acid
CID 122009637
3-ethyl-1-[1-(furan-2-yl)propan-2-ylcarbamoyl]pyrrolidine-3-carboxylic acid
CID 63147179

Frequently Asked Questions

What is the IUPAC name of (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide?
The IUPAC name of (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide (CID 97087871) is (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide?
The canonical SMILES for (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide is CC(=O)N[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccco2)C1.
What is the InChIKey of (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide?
The InChIKey is MNZHVKZJDXHVGB-WCQYABFASA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11(9-14-6-4-8-21-14)16-15(20)18-7-3-5-13(10-18)17-12(2)19/h4,6,8,11,13H,3,5,7,9-10H2,1-2H3,(H,16,20)(H,17,19)/t11-,13+/m0/s1.
What are the key properties of (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide?
(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 97087871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).