5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide

C17H15N5O2 — CID 177283482

IUPAC5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide
SMILESCc1ccc(O)cc1-c1nc(-c2cccnc2)nc(C(N)=O)c1N
InChIInChI=1S/C17H15N5O2/c1-9-4-5-11(23)7-12(9)14-13(18)15(16(19)24)22-17(21-14)10-3-2-6-20-8-10/h2-8,23H,18H2,1H3,(H2,19,24)
InChIKeyBYJVLDJTTJXARQ-UHFFFAOYSA-N
MW321.34 g/mol
LogP1.90
Rot. Bonds3

About 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide

5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide (PubChem CID 177283482) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide
PubChem CID177283482
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC Name5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide
SMILESCc1ccc(O)cc1-c1nc(-c2cccnc2)nc(C(N)=O)c1N
InChIInChI=1S/C17H15N5O2/c1-9-4-5-11(23)7-12(9)14-13(18)15(16(19)24)22-17(21-14)10-3-2-6-20-8-10/h2-8,23H,18H2,1H3,(H2,19,24)
InChIKeyBYJVLDJTTJXARQ-UHFFFAOYSA-N
XLogP1.90
TPSA128.01 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

Dipyridodiazepinone deriv. 61
CID 463188
Dipyridodiazepinone deriv. 58
CID 463578
6'-amino-4'-ethyl-5'-(4-hydroxyphenyl)-N-methyl-[3,3'-bipyridine]-6-carboxamide
CID 122531750
6-cyclopropyl-N-(4-hydroxy-3-propanoylphenyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415265
6-cyclopropyl-N-(4-hydroxy-5-oxo-7,8-dihydro-6H-naphthalen-1-yl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415304
3-Amino-4-(3-hydroxy-2-methylphenyl)-1,5-naphthyridine-2-carboxamide
CID 171645002
3-Amino-4-(3-hydroxy-2,6-dimethylphenyl)-1,5-naphthyridine-2-carboxamide
CID 171645068
7-Amino-8-(3-hydroxy-2,6-dimethylphenyl)pyrido[2,3-b]pyrazine-6-carboxamide
CID 171645242
US9579320, Example 406
CID 59199811
6-(3-Hydroxyphenyl)-3-(pyridin-2-ylmethyl)pyrido[3,2-d]pyrimidin-4-one
CID 134810944
5,11-Dihydro-11-ethyl-5-methyl-8-[2-(3-hydroxyphenyl)ethyl]-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
CID 15956323
5-Amino-2-(4,4-difluorocyclohexyl)-6-(5-hydroxy-2-methylphenyl)pyrimidine-4-carboxamide
CID 170346746

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide?
The IUPAC name of 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide (CID 177283482) is 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide?
The canonical SMILES for 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide is Cc1ccc(O)cc1-c1nc(-c2cccnc2)nc(C(N)=O)c1N.
What is the InChIKey of 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide?
The InChIKey is BYJVLDJTTJXARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-9-4-5-11(23)7-12(9)14-13(18)15(16(19)24)22-17(21-14)10-3-2-6-20-8-10/h2-8,23H,18H2,1H3,(H2,19,24).
What are the key properties of 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide?
5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide has a molecular weight of 321.34 g/mol, XLogP of 1.90, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(5-hydroxy-2-methylphenyl)-2-pyridin-3-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 177283482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).