1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide

C13H20N4O2 — CID 171700843

IUPAC1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cc(N2CCC(C(=O)N(C)C)CC2)ncn1
InChIInChI=1S/C13H20N4O2/c1-16(2)13(18)10-4-6-17(7-5-10)11-8-12(19-3)15-9-14-11/h8-10H,4-7H2,1-3H3
InChIKeyRTENQTVKGJLERY-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.79
Rot. Bonds3

About 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide

1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 171700843) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
PubChem CID171700843
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cc(N2CCC(C(=O)N(C)C)CC2)ncn1
InChIInChI=1S/C13H20N4O2/c1-16(2)13(18)10-4-6-17(7-5-10)11-8-12(19-3)15-9-14-11/h8-10H,4-7H2,1-3H3
InChIKeyRTENQTVKGJLERY-UHFFFAOYSA-N
XLogP0.79
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-1-(6-methoxypyrimidin-4-yl)piperidine-4-carboxamide
CID 163345372
(3R)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839552
(3S)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839551
1-(4-methoxypyrimidin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 31968556
2-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]propan-2-ol
CID 172899245
1-(5-bromo-4-methoxypyrimidin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171690356
(3S)-N,N-diethyl-1-(6-methoxypyrimidin-4-yl)piperidine-3-carboxamide
CID 95125854
1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperazine-2-carboxamide
CID 66318976
1-(6-methoxypyrimidin-4-yl)azocane-2-carboxylic acid
CID 114239764
1-(5-cyano-2-pyridinyl)-N,N-dimethylpiperidine-4-carboxamide
CID 51300981
1-[6-(4-methoxyphenyl)pyrimidin-4-yl]-N-methyl-N-phenylpiperidine-4-carboxamide
CID 90519567
1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171691583

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide (CID 171700843) is 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide is COc1cc(N2CCC(C(=O)N(C)C)CC2)ncn1.
What is the InChIKey of 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is RTENQTVKGJLERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-16(2)13(18)10-4-6-17(7-5-10)11-8-12(19-3)15-9-14-11/h8-10H,4-7H2,1-3H3.
What are the key properties of 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide?
1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.79, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 171700843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).