5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide

C15H15ClN4O — CID 109271670

IUPAC5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide
SMILESCc1ccc(Cl)cc1Nc1cnc(C(=O)NC2CC2)cn1
InChIInChI=1S/C15H15ClN4O/c1-9-2-3-10(16)6-12(9)20-14-8-17-13(7-18-14)15(21)19-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,18,20)(H,19,21)
InChIKeyGTBBCVREPDMQPB-UHFFFAOYSA-N
MW302.77 g/mol
LogP3.07
Rot. Bonds4

About 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide

5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide (PubChem CID 109271670) has the molecular formula C15H15ClN4O and a molecular weight of 302.77 g/mol. Its IUPAC name is 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide
PubChem CID109271670
Molecular FormulaC15H15ClN4O
Molecular Weight302.77 g/mol
Exact Mass302.09
IUPAC Name5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide
SMILESCc1ccc(Cl)cc1Nc1cnc(C(=O)NC2CC2)cn1
InChIInChI=1S/C15H15ClN4O/c1-9-2-3-10(16)6-12(9)20-14-8-17-13(7-18-14)15(21)19-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,18,20)(H,19,21)
InChIKeyGTBBCVREPDMQPB-UHFFFAOYSA-N
XLogP3.07
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.77
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide 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-cyclopentyl-5-(2-methylanilino)pyrazine-2-carboxamide
CID 109273966
N-(3-chloro-4-fluorophenyl)-5-(5-chloro-2-methylanilino)pyrazine-2-carboxamide
CID 109293026
5-(3-bromo-4-methylanilino)-N-cyclopropylpyrazine-2-carboxamide
CID 109271678
5-[4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylpyrazine-2-carboxamide
CID 109274799
N-cyclopropyl-5-[4-(diethylamino)-2-methylanilino]pyrazine-2-carboxamide
CID 109271738
5-(3-chloro-4-fluoroanilino)-N-cyclopropylpyrazine-2-carboxamide
CID 109271673
5-(2-chloroanilino)-N-(5-chloro-2-methylphenyl)pyrazine-2-carboxamide
CID 109292659
N-cyclopropyl-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109271723
5-(5-chloro-2-methylanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280832
5-(5-chloro-2-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide
CID 109283846
5-(5-chloro-2-methylanilino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109293027
5-(5-chloro-2-methylanilino)-N-(4-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293034

Frequently Asked Questions

What is the IUPAC name of 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide?
The IUPAC name of 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide (CID 109271670) is 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide?
The canonical SMILES for 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide is Cc1ccc(Cl)cc1Nc1cnc(C(=O)NC2CC2)cn1.
What is the InChIKey of 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide?
The InChIKey is GTBBCVREPDMQPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4O/c1-9-2-3-10(16)6-12(9)20-14-8-17-13(7-18-14)15(21)19-11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide?
5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide has a molecular weight of 302.77 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-chloro-2-methylanilino)-N-cyclopropylpyrazine-2-carboxamide is sourced from PubChem (CID 109271670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).