1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide

C14H20N4O2 — CID 136687973

IUPAC1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2cc(=O)[nH]c(C3CC3)n2)C1
InChIInChI=1S/C14H20N4O2/c1-15-14(20)10-3-2-6-18(8-10)11-7-12(19)17-13(16-11)9-4-5-9/h7,9-10H,2-6,8H2,1H3,(H,15,20)(H,16,17,19)
InChIKeyRLUFBQLCFCJMPN-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.61
Rot. Bonds3

About 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide

1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide (PubChem CID 136687973) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
PubChem CID136687973
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2cc(=O)[nH]c(C3CC3)n2)C1
InChIInChI=1S/C14H20N4O2/c1-15-14(20)10-3-2-6-18(8-10)11-7-12(19)17-13(16-11)9-4-5-9/h7,9-10H,2-6,8H2,1H3,(H,15,20)(H,16,17,19)
InChIKeyRLUFBQLCFCJMPN-UHFFFAOYSA-N
XLogP0.61
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4,6-dihydroxy-2-pyrimidinyl)ethyl]-2-(1-ethyl-4-piperidinyl)acetamide
CID 72874444
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-2-(1-ethyl-4-piperidinyl)acetamide
CID 136216738
N-ethyl-1-(2-methyl-6-oxo-1H-pyrimidin-4-yl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 139019818
N-(2,2-difluoroethyl)-1-(1-methyl-6-oxopyrimidin-4-yl)piperidine-3-carboxamide
CID 177802488
N,2-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine-9-carboxamide
CID 12339736
N-[3-(dimethylamino)propyl]-2-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine-9-carboxamide
CID 12339737
N-[(6-hydroxy-2-methyl-4-pyrimidinyl)methyl]-1-isopropyl-3-piperidinecarboxamide
CID 136217022
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-1-cyclopentyl-3-piperidinecarboxamide
CID 136228404
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-3-(1-methyl-3-piperidinyl)propanamide
CID 136233477
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-2-(1-isopropyl-4-piperidinyl)acetamide
CID 136233486
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-1-isopropyl-3-piperidinecarboxamide
CID 136249179
N-[2-(4-amino-6-hydroxy-2-pyrimidinyl)ethyl]-1-ethyl-3-methyl-3-piperidinecarboxamide
CID 136262750

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide (CID 136687973) is 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(c2cc(=O)[nH]c(C3CC3)n2)C1.
What is the InChIKey of 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide?
The InChIKey is RLUFBQLCFCJMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-15-14(20)10-3-2-6-18(8-10)11-7-12(19)17-13(16-11)9-4-5-9/h7,9-10H,2-6,8H2,1H3,(H,15,20)(H,16,17,19).
What are the key properties of 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide?
1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 136687973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).