2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride

C15H14ClN4- — CID 53346777

IUPAC2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride
SMILESCc1nc(NCc2ccccn2)c2ccccc2n1.[Cl-]
InChIInChI=1S/C15H14N4.ClH/c1-11-18-14-8-3-2-7-13(14)15(19-11)17-10-12-6-4-5-9-16-12;/h2-9H,10H2,1H3,(H,17,18,19);1H/p-1
InChIKeyOXWJWQIYUYZJCT-UHFFFAOYSA-M
MW285.76 g/mol
LogP-0.05
Rot. Bonds3

About 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride

2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride (PubChem CID 53346777) has the molecular formula C15H14ClN4- and a molecular weight of 285.76 g/mol. Its IUPAC name is 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride.

Molecular Properties

Compound Name2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride
PubChem CID53346777
Molecular FormulaC15H14ClN4-
Molecular Weight285.76 g/mol
Exact Mass285.09
IUPAC Name2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride
SMILESCc1nc(NCc2ccccn2)c2ccccc2n1.[Cl-]
InChIInChI=1S/C15H14N4.ClH/c1-11-18-14-8-3-2-7-13(14)15(19-11)17-10-12-6-4-5-9-16-12;/h2-9H,10H2,1H3,(H,17,18,19);1H/p-1
InChIKeyOXWJWQIYUYZJCT-UHFFFAOYSA-M
XLogP-0.05
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.76
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine
CID 4880961
2-phenyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine;dihydrochloride
CID 45261670
2-[(dimethylamino)methyl]-N-(pyridin-2-ylmethyl)quinazolin-4-amine
CID 21003940
6-chloro-2,5-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 63728239
2-methyl-N-(pyridin-2-ylmethyl)-[1]benzofuro[3,2-d]pyrimidin-4-amine
CID 2063127
N-(pyridin-2-ylmethyl)-2-thiophen-2-ylquinazolin-4-amine
CID 2576648
6-ethyl-2-methyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 6458164
4-N-[(2-methylpyrimidin-4-yl)methyl]quinazoline-2,4-diamine
CID 80813250
N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine
CID 68649031
6-methyl-2-N-(pyridin-2-ylmethyl)pyridine-2,3-diamine
CID 81132178
N-[(3-fluorophenyl)methyl]-2-methylquinazolin-4-amine
CID 69221219
5-methyl-2-N,4-N-bis(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 71922543

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride?
The IUPAC name of 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride (CID 53346777) is 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride.
What is the SMILES notation for 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride?
The canonical SMILES for 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride is Cc1nc(NCc2ccccn2)c2ccccc2n1.[Cl-].
What is the InChIKey of 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride?
The InChIKey is OXWJWQIYUYZJCT-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H14N4.ClH/c1-11-18-14-8-3-2-7-13(14)15(19-11)17-10-12-6-4-5-9-16-12;/h2-9H,10H2,1H3,(H,17,18,19);1H/p-1.
What are the key properties of 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride?
2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride has a molecular weight of 285.76 g/mol, XLogP of -0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride is sourced from PubChem (CID 53346777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).