2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

C18H17N5O2 — CID 44520950

IUPAC2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)NCc2ccccn2)nc(N)n1
InChIInChI=1S/C18H17N5O2/c1-25-16-8-3-2-7-13(16)14-10-15(23-18(19)22-14)17(24)21-11-12-6-4-5-9-20-12/h2-10H,11H2,1H3,(H,21,24)(H2,19,22,23)
InChIKeyZVYYCMRDDCYZAU-UHFFFAOYSA-N
MW335.37 g/mol
LogP2.06
Rot. Bonds5

About 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 44520950) has the molecular formula C18H17N5O2 and a molecular weight of 335.37 g/mol. Its IUPAC name is 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID44520950
Molecular FormulaC18H17N5O2
Molecular Weight335.37 g/mol
Exact Mass335.14
IUPAC Name2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)NCc2ccccn2)nc(N)n1
InChIInChI=1S/C18H17N5O2/c1-25-16-8-3-2-7-13(16)14-10-15(23-18(19)22-14)17(24)21-11-12-6-4-5-9-20-12/h2-10H,11H2,1H3,(H,21,24)(H2,19,22,23)
InChIKeyZVYYCMRDDCYZAU-UHFFFAOYSA-N
XLogP2.06
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[6-(3-methoxyphenyl)pyrimidin-4-yl]piperidin-4-yl]-N-methyl-7-oxo-6-prop-2-enyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 135394452
4-methyl-3-((3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yl)oxy)-N-(3-(trifluoromethyl)phenyl)benzamide
CID 16108977
6-cyclopropyl-N-[4-methoxy-2-(methylcarbamoyl)phenyl]-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 58548303
N-(3-imidazol-1-ylpropyl)-8-(4-methoxyphenyl)-1,6-naphthyridine-2-carboxamide
CID 4055067
Pyrimidine-4-carboxamide, 26
CID 11220580
Pyrimidine-4-carboxamide, 109
CID 11324754
[4-Amino-2-[4-(4-methylpiperazin-1-yl)phenylamino]pyrimidin-5-yl](2-methoxyphenyl)methanone
CID 11975203
4-methyl-3-(3-(pyrimidin-4-yl)pyridin-2-yloxy)-N-(3-(trifluoromethyl)phenyl)benzamide
CID 16108986
4-methyl-3-(3-(pyrimidin-4-yl)pyridin-2-yloxy)-N-(4-(trifluoromethyl)phenyl)benzamide
CID 16108987
Pyrimidine-4-carboxamide, 27
CID 44520941
4-Pyrimidinecarboxamide,2-amino-6-(3-methoxyphenyl)-n-(2-pyridinylmethyl)-
CID 44520951
4-Pyrimidinecarboxamide,2-amino-6-(3-methoxyphenyl)-n-[(3-methyl-2-pyridinyl)methyl]-
CID 44520964

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (CID 44520950) is 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is COc1ccccc1-c1cc(C(=O)NCc2ccccn2)nc(N)n1.
What is the InChIKey of 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is ZVYYCMRDDCYZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O2/c1-25-16-8-3-2-7-13(16)14-10-15(23-18(19)22-14)17(24)21-11-12-6-4-5-9-20-12/h2-10H,11H2,1H3,(H,21,24)(H2,19,22,23).
What are the key properties of 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 335.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 44520950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).