2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide

C18H27N3O3 — CID 95176270

IUPAC2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN([C@H](C)C(=O)N2CCCC2)CC1
InChIInChI=1S/C18H27N3O3/c1-13(18(23)21-8-3-4-9-21)20-10-5-15(6-11-20)19-17(22)16-7-12-24-14(16)2/h7,12-13,15H,3-6,8-11H2,1-2H3,(H,19,22)/t13-/m1/s1
InChIKeyDPBQCPZKKHPXIO-CYBMUJFWSA-N
MW333.43 g/mol
LogP1.79
Rot. Bonds4

About 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide

2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide (PubChem CID 95176270) has the molecular formula C18H27N3O3 and a molecular weight of 333.43 g/mol. Its IUPAC name is 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide
PubChem CID95176270
Molecular FormulaC18H27N3O3
Molecular Weight333.43 g/mol
Exact Mass333.21
IUPAC Name2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN([C@H](C)C(=O)N2CCCC2)CC1
InChIInChI=1S/C18H27N3O3/c1-13(18(23)21-8-3-4-9-21)20-10-5-15(6-11-20)19-17(22)16-7-12-24-14(16)2/h7,12-13,15H,3-6,8-11H2,1-2H3,(H,19,22)/t13-/m1/s1
InChIKeyDPBQCPZKKHPXIO-CYBMUJFWSA-N
XLogP1.79
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide with MolForge

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Related Compounds

N-[1-(3-amino-2-methyl-3-phenylpropanoyl)piperidin-4-yl]-2-methylfuran-3-carboxamide;hydrochloride
CID 119771791
N-[1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-4-yl]-2-methylfuran-3-carboxamide
CID 124623652
2-methyl-N-[1-(3-piperidin-3-ylbutanoyl)piperidin-4-yl]furan-3-carboxamide;hydrochloride
CID 119771793
tert-butyl N-[1-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]carbamate
CID 95300418
N-[1-[(2R)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1-oxopropan-2-yl]piperidin-4-yl]benzamide
CID 33103822
2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide
CID 120930820
6-[4-[(2-methylfuran-3-carbonyl)amino]piperidin-1-yl]pyridine-2-carboxylic acid
CID 122053563
2-methyl-N-[2-oxo-2-[4-(thiophene-3-carbonylamino)piperidin-1-yl]ethyl]furan-3-carboxamide
CID 47713489
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylfuran-3-carboxamide
CID 104927715
2-methyl-N-[1-[3-(5-methyl-3-pyridinyl)propanoyl]piperidin-4-yl]furan-3-carboxamide
CID 136544454
2-methyl-N-[1-[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]piperidin-4-yl]furan-3-carboxamide
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N-[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-4-yl]-2-methylfuran-3-carboxamide
CID 133361207

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide (CID 95176270) is 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide is Cc1occc1C(=O)NC1CCN([C@H](C)C(=O)N2CCCC2)CC1.
What is the InChIKey of 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide?
The InChIKey is DPBQCPZKKHPXIO-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H27N3O3/c1-13(18(23)21-8-3-4-9-21)20-10-5-15(6-11-20)19-17(22)16-7-12-24-14(16)2/h7,12-13,15H,3-6,8-11H2,1-2H3,(H,19,22)/t13-/m1/s1.
What are the key properties of 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide?
2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide is sourced from PubChem (CID 95176270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).