N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine

C14H13N5O — CID 42625912

IUPACN-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine
SMILESCOc1cnc(Nc2nc(C)nc3ccccc23)nc1
InChIInChI=1S/C14H13N5O/c1-9-17-12-6-4-3-5-11(12)13(18-9)19-14-15-7-10(20-2)8-16-14/h3-8H,1-2H3,(H,15,16,17,18,19)
InChIKeyWURDJMHVVPMHJB-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.48
Rot. Bonds3

About N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine

N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine (PubChem CID 42625912) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine
PubChem CID42625912
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine
SMILESCOc1cnc(Nc2nc(C)nc3ccccc23)nc1
InChIInChI=1S/C14H13N5O/c1-9-17-12-6-4-3-5-11(12)13(18-9)19-14-15-7-10(20-2)8-16-14/h3-8H,1-2H3,(H,15,16,17,18,19)
InChIKeyWURDJMHVVPMHJB-UHFFFAOYSA-N
XLogP2.48
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-benzyl-2-(pyridin-3-yl)quinazolin-4-amine
CID 667555
4-Anilino quinazoline deriv. 18
CID 5328017
2-(6-methylpyridin-2-yl)-N-(pyridin-4-yl)quinazolin-4-amine
CID 10267580
N-benzyl-2-pyridin-4-ylquinazolin-4-amine
CID 921562
BMS-181101 free base
CID 177836
4-N-phenylpyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328051
4-N-(3-methylphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328073
4-N-benzylpyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328077
4-N-[(2-aminophenyl)methyl]pyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328090
2-phenyl-N-(pyridin-4-yl)quinazolin-4-amine
CID 6456587
1-Phenyl-3-(2-(pyridin-3-yl)quinazolin-4-yl)urea
CID 10688595
N-(4-{[(2-Methoxyethyl)amino]methyl}phenyl)-6-(Pyridin-4-Yl)quinazolin-2-Amine
CID 70702306

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine?
The IUPAC name of N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine (CID 42625912) is N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine.
What is the SMILES notation for N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine?
The canonical SMILES for N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine is COc1cnc(Nc2nc(C)nc3ccccc23)nc1.
What is the InChIKey of N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine?
The InChIKey is WURDJMHVVPMHJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-9-17-12-6-4-3-5-11(12)13(18-9)19-14-15-7-10(20-2)8-16-14/h3-8H,1-2H3,(H,15,16,17,18,19).
What are the key properties of N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine?
N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine has a molecular weight of 267.29 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxypyrimidin-2-yl)-2-methylquinazolin-4-amine is sourced from PubChem (CID 42625912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).