N-[(2-methoxyphenyl)methyl]quinazolin-2-amine

C16H15N3O — CID 114788826

IUPACN-[(2-methoxyphenyl)methyl]quinazolin-2-amine
SMILESCOc1ccccc1CNc1ncc2ccccc2n1
InChIInChI=1S/C16H15N3O/c1-20-15-9-5-3-7-13(15)11-18-16-17-10-12-6-2-4-8-14(12)19-16/h2-10H,11H2,1H3,(H,17,18,19)
InChIKeyKKHSVVLXGFRFBQ-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.25
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]quinazolin-2-amine

N-[(2-methoxyphenyl)methyl]quinazolin-2-amine (PubChem CID 114788826) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]quinazolin-2-amine.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]quinazolin-2-amine
PubChem CID114788826
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN-[(2-methoxyphenyl)methyl]quinazolin-2-amine
SMILESCOc1ccccc1CNc1ncc2ccccc2n1
InChIInChI=1S/C16H15N3O/c1-20-15-9-5-3-7-13(15)11-18-16-17-10-12-6-2-4-8-14(12)19-16/h2-10H,11H2,1H3,(H,17,18,19)
InChIKeyKKHSVVLXGFRFBQ-UHFFFAOYSA-N
XLogP3.25
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methoxy-N-[(2-methoxyphenyl)methyl]pyrimidin-2-amine
CID 103726609
5-bromo-2-N-ethyl-4-N-[(2-methoxyphenyl)methyl]pyrimidine-2,4-diamine
CID 80769855
2-N-benzyl-4-N-[(2-methoxyphenyl)methyl]pyrimidine-2,4-diamine
CID 112889572
2-N-cyclopentyl-4-N-[(2-methoxyphenyl)methyl]quinazoline-2,4-diamine
CID 91963368
4-N-[(2-chlorophenyl)methyl]-2-N-[(2-methoxyphenyl)methyl]pyrimidine-2,4-diamine
CID 112891638
2-N-[(2-methoxyphenyl)methyl]-4-N-(2-methylpropyl)pyrimidine-2,4-diamine
CID 112883170
N-[(4-aminophenyl)methyl]quinazolin-2-amine
CID 114789553
N-[(2-methoxyphenyl)methyl]-2H-tetrazol-5-amine
CID 961498
1-(quinazolin-2-ylamino)propan-2-ol
CID 114788870
2-N-[(2-methoxyphenyl)methyl]-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112892258
5-chloro-N-[(2-methoxyphenyl)methyl]pyridin-2-amine
CID 28548307
N-[2-(2-methoxyphenyl)ethyl]-1,2,4-benzotriazin-3-amine
CID 106261896

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]quinazolin-2-amine?
The IUPAC name of N-[(2-methoxyphenyl)methyl]quinazolin-2-amine (CID 114788826) is N-[(2-methoxyphenyl)methyl]quinazolin-2-amine.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]quinazolin-2-amine?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]quinazolin-2-amine is COc1ccccc1CNc1ncc2ccccc2n1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]quinazolin-2-amine?
The InChIKey is KKHSVVLXGFRFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-20-15-9-5-3-7-13(15)11-18-16-17-10-12-6-2-4-8-14(12)19-16/h2-10H,11H2,1H3,(H,17,18,19).
What are the key properties of N-[(2-methoxyphenyl)methyl]quinazolin-2-amine?
N-[(2-methoxyphenyl)methyl]quinazolin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]quinazolin-2-amine is sourced from PubChem (CID 114788826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).