N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide

C19H26N4O2 — CID 56701761

IUPACN-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SMILESCC1=C(C(=O)NC2CCN(Cc3ccccc3)CC2)C(C)NC(=O)N1
InChIInChI=1S/C19H26N4O2/c1-13-17(14(2)21-19(25)20-13)18(24)22-16-8-10-23(11-9-16)12-15-6-4-3-5-7-15/h3-7,13,16H,8-12H2,1-2H3,(H,22,24)(H2,20,21,25)
InChIKeyVUVXJMSSVGBHLX-UHFFFAOYSA-N
MW342.44 g/mol
LogP1.74
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide

N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide (PubChem CID 56701761) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
PubChem CID56701761
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SMILESCC1=C(C(=O)NC2CCN(Cc3ccccc3)CC2)C(C)NC(=O)N1
InChIInChI=1S/C19H26N4O2/c1-13-17(14(2)21-19(25)20-13)18(24)22-16-8-10-23(11-9-16)12-15-6-4-3-5-7-15/h3-7,13,16H,8-12H2,1-2H3,(H,22,24)(H2,20,21,25)
InChIKeyVUVXJMSSVGBHLX-UHFFFAOYSA-N
XLogP1.74
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]benzamide
CID 2729497
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CID 2712549
N-(1-benzylpiperidin-4-yl)-6-methylpyridine-2-carboxamide
CID 31926879
ethyl (4R)-6-[(4-benzylpiperazin-1-yl)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 30726130
N-(1-benzylpiperidin-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 136666398
N-(1-benzylpiperidin-4-yl)-3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
CID 20861431
N-(1-benzylpiperidin-4-yl)-4-bromobenzamide
CID 1103952
1-amino-N-(1-benzylpiperidin-4-yl)cyclopropane-1-carboxamide;dihydrochloride
CID 119827542
N-(1-benzylpiperidin-4-yl)-4-propan-2-ylbenzamide
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2-anilino-N-(1-benzylpiperidin-4-yl)benzamide
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N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-methylbenzamide
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N-(1-benzylpiperidin-4-yl)-4-methoxybenzamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide (CID 56701761) is N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide is CC1=C(C(=O)NC2CCN(Cc3ccccc3)CC2)C(C)NC(=O)N1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The InChIKey is VUVXJMSSVGBHLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-13-17(14(2)21-19(25)20-13)18(24)22-16-8-10-23(11-9-16)12-15-6-4-3-5-7-15/h3-7,13,16H,8-12H2,1-2H3,(H,22,24)(H2,20,21,25).
What are the key properties of N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 1.74, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-4,6-dimethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 56701761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).