1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide

C21H29N3O2 — CID 97208999

IUPAC1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide
SMILESCc1ccnc(C[C@@H](C)N(C)C(=O)C2CCN(Cc3ccco3)CC2)c1
InChIInChI=1S/C21H29N3O2/c1-16-6-9-22-19(13-16)14-17(2)23(3)21(25)18-7-10-24(11-8-18)15-20-5-4-12-26-20/h4-6,9,12-13,17-18H,7-8,10-11,14-15H2,1-3H3/t17-/m1/s1
InChIKeySMVXJNOCQCYLNE-QGZVFWFLSA-N
MW355.48 g/mol
LogP3.28
Rot. Bonds6

About 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide

1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide (PubChem CID 97208999) has the molecular formula C21H29N3O2 and a molecular weight of 355.48 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide
PubChem CID97208999
Molecular FormulaC21H29N3O2
Molecular Weight355.48 g/mol
Exact Mass355.23
IUPAC Name1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide
SMILESCc1ccnc(C[C@@H](C)N(C)C(=O)C2CCN(Cc3ccco3)CC2)c1
InChIInChI=1S/C21H29N3O2/c1-16-6-9-22-19(13-16)14-17(2)23(3)21(25)18-7-10-24(11-8-18)15-20-5-4-12-26-20/h4-6,9,12-13,17-18H,7-8,10-11,14-15H2,1-3H3/t17-/m1/s1
InChIKeySMVXJNOCQCYLNE-QGZVFWFLSA-N
XLogP3.28
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.48
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

1-(furan-2-ylmethyl)-N-[(2S)-1-pyrazin-2-ylpropan-2-yl]piperidine-4-carboxamide
CID 97190312
1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
CID 72847764
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788
3-(2,3-dihydro-1H-inden-2-yl)-1-methyl-1-[(2S)-1-(4-methyl-2-pyridinyl)propan-2-yl]urea
CID 126427606
N-[2-(4,6-dimethylpyrimidin-2-yl)ethyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 91775679
4-[methyl-[1-(4-methyl-2-pyridinyl)propan-2-yl]amino]-4-oxobutanoic acid
CID 121496087
N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide
CID 50974230
N,1-dimethyl-N-[1-(4-methyl-2-pyridinyl)propan-2-yl]indazole-3-carboxamide
CID 46996222
1-(furan-2-ylmethyl)-N-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)piperidine-4-carboxamide
CID 72921377
5-(difluoromethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]-1H-pyrazole-3-carboxamide
CID 126439688
[(2S,6S)-2,6-dimethylmorpholin-4-yl]-[1-(furan-2-ylmethyl)piperidin-4-yl]methanone
CID 97147422
N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 134698283

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide (CID 97208999) is 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide is Cc1ccnc(C[C@@H](C)N(C)C(=O)C2CCN(Cc3ccco3)CC2)c1.
What is the InChIKey of 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide?
The InChIKey is SMVXJNOCQCYLNE-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H29N3O2/c1-16-6-9-22-19(13-16)14-17(2)23(3)21(25)18-7-10-24(11-8-18)15-20-5-4-12-26-20/h4-6,9,12-13,17-18H,7-8,10-11,14-15H2,1-3H3/t17-/m1/s1.
What are the key properties of 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide?
1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide has a molecular weight of 355.48 g/mol, XLogP of 3.28, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-N-methyl-N-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 97208999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).