N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide

C13H12ClN3O2 — CID 169231782

IUPACN-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide
SMILESCOc1cc2ncnc(Cl)c2cc1NC(=O)C1CC1
InChIInChI=1S/C13H12ClN3O2/c1-19-11-5-9-8(12(14)16-6-15-9)4-10(11)17-13(18)7-2-3-7/h4-7H,2-3H2,1H3,(H,17,18)
InChIKeyRCGARVRYZGOKOF-UHFFFAOYSA-N
MW277.71 g/mol
LogP2.64
Rot. Bonds3

About N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide

N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide (PubChem CID 169231782) has the molecular formula C13H12ClN3O2 and a molecular weight of 277.71 g/mol. Its IUPAC name is N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide
PubChem CID169231782
Molecular FormulaC13H12ClN3O2
Molecular Weight277.71 g/mol
Exact Mass277.06
IUPAC NameN-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide
SMILESCOc1cc2ncnc(Cl)c2cc1NC(=O)C1CC1
InChIInChI=1S/C13H12ClN3O2/c1-19-11-5-9-8(12(14)16-6-15-9)4-10(11)17-13(18)7-2-3-7/h4-7H,2-3H2,1H3,(H,17,18)
InChIKeyRCGARVRYZGOKOF-UHFFFAOYSA-N
XLogP2.64
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.71
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methoxy-4,5-dimethylphenyl)cyclopropanecarboxamide
CID 110776819
N-[7-methoxy-4-(2-methyl-4-phenyl-1,3-thiazol-5-yl)quinazolin-6-yl]cyclopropanecarboxamide
CID 169231534
(4-chloro-7-methoxyquinazolin-6-yl) 2,2-dimethylpropanoate
CID 122446171
(4-chloro-7-methoxyquinazolin-6-yl) acetate;hydrochloride
CID 22022159
N-(4-chloro-2,5-dimethoxyphenyl)thiane-4-carboxamide
CID 110864457
tert-butyl 2-[[7-methoxy-4-(methylamino)quinazolin-6-yl]carbamoyl]pyrrolidine-1-carboxylate
CID 121408953
N-[5-[2-(3,4-dichlorophenyl)acetyl]-2-methoxyphenyl]cyclopropanecarboxamide
CID 148520683
4-N-(2-chlorophenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109150938
N-[5-(4-chloro-2,5-dimethoxyanilino)-2-pyridinyl]cyclopropanecarboxamide
CID 113036885
1-acetyl-N-(4-chloro-2,5-dimethoxyphenyl)piperidine-4-carboxamide
CID 6466145
(4-chloro-7-methoxyquinolin-6-yl)carbamic acid
CID 22936428
4-N-(4-chloro-2,5-dimethoxyphenyl)-1-N-(2-methylpropyl)cyclohexane-1,4-dicarboxamide
CID 109145385

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide?
The IUPAC name of N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide (CID 169231782) is N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide is COc1cc2ncnc(Cl)c2cc1NC(=O)C1CC1.
What is the InChIKey of N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide?
The InChIKey is RCGARVRYZGOKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O2/c1-19-11-5-9-8(12(14)16-6-15-9)4-10(11)17-13(18)7-2-3-7/h4-7H,2-3H2,1H3,(H,17,18).
What are the key properties of N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide?
N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide has a molecular weight of 277.71 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-7-methoxyquinazolin-6-yl)cyclopropanecarboxamide is sourced from PubChem (CID 169231782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).