N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide

C19H13N5O — CID 177046877

IUPACN-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide
SMILESO=C(Nc1ccc2cccnc2n1)c1ncc(-c2ccccc2)cn1
InChIInChI=1S/C19H13N5O/c25-19(24-16-9-8-14-7-4-10-20-17(14)23-16)18-21-11-15(12-22-18)13-5-2-1-3-6-13/h1-12H,(H,20,23,24,25)
InChIKeyCGWAPRXILHEIKF-UHFFFAOYSA-N
MW327.35 g/mol
LogP3.34
Rot. Bonds3

About N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide

N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide (PubChem CID 177046877) has the molecular formula C19H13N5O and a molecular weight of 327.35 g/mol. Its IUPAC name is N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide
PubChem CID177046877
Molecular FormulaC19H13N5O
Molecular Weight327.35 g/mol
Exact Mass327.11
IUPAC NameN-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide
SMILESO=C(Nc1ccc2cccnc2n1)c1ncc(-c2ccccc2)cn1
InChIInChI=1S/C19H13N5O/c25-19(24-16-9-8-14-7-4-10-20-17(14)23-16)18-21-11-15(12-22-18)13-5-2-1-3-6-13/h1-12H,(H,20,23,24,25)
InChIKeyCGWAPRXILHEIKF-UHFFFAOYSA-N
XLogP3.34
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-chlorophenyl)-N-(1,8-naphthyridin-2-yl)pyridine-3-carboxamide
CID 177047263
5-phenyl-N-pyridin-2-ylpyridine-2-carboxamide
CID 110683613
N-(1,8-naphthyridin-2-yl)-1,8-naphthyridin-2-amine
CID 45117995
5-bromo-4-methyl-N-(1,8-naphthyridin-2-yl)-1H-pyrazole-3-carboxamide
CID 177046812
6-(4-cyclopropylphenyl)-N-(1,8-naphthyridin-2-yl)pyridine-3-carboxamide
CID 177047597
3-(3-ethylphenyl)-N-(1,8-naphthyridin-2-yl)-1H-pyrazole-5-carboxamide
CID 177047187
5-methyl-1-(2-methylphenyl)-N-(1,8-naphthyridin-2-yl)triazole-4-carboxamide
CID 166156402
5-methyl-N-pyridin-2-ylpyrimidine-2-carboxamide
CID 134531316
N-[6-[2-(1,8-naphthyridin-2-yl)ethyl]-2-pyridinyl]acetamide
CID 91134508
4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide
CID 71449507
sodium N-(1,8-naphthyridin-2-yl)nitrous amide
CID 54607944
(5-phenyl-2-pyridinyl)carbamic acid
CID 69225879

Frequently Asked Questions

What is the IUPAC name of N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide?
The IUPAC name of N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide (CID 177046877) is N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide.
What is the SMILES notation for N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide?
The canonical SMILES for N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide is O=C(Nc1ccc2cccnc2n1)c1ncc(-c2ccccc2)cn1.
What is the InChIKey of N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide?
The InChIKey is CGWAPRXILHEIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N5O/c25-19(24-16-9-8-14-7-4-10-20-17(14)23-16)18-21-11-15(12-22-18)13-5-2-1-3-6-13/h1-12H,(H,20,23,24,25).
What are the key properties of N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide?
N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide has a molecular weight of 327.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,8-naphthyridin-2-yl)-5-phenylpyrimidine-2-carboxamide is sourced from PubChem (CID 177046877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).