N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide

C17H15ClN4O — CID 171680243

IUPACN-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide
SMILESO=C(NCC1(c2ccc(Cl)cc2)CC1)c1cnc2cnccn12
InChIInChI=1S/C17H15ClN4O/c18-13-3-1-12(2-4-13)17(5-6-17)11-21-16(23)14-9-20-15-10-19-7-8-22(14)15/h1-4,7-10H,5-6,11H2,(H,21,23)
InChIKeyKLUIVYYTJVNXCC-UHFFFAOYSA-N
MW326.79 g/mol
LogP2.84
Rot. Bonds4

About N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide

N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 171680243) has the molecular formula C17H15ClN4O and a molecular weight of 326.79 g/mol. Its IUPAC name is N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide
PubChem CID171680243
Molecular FormulaC17H15ClN4O
Molecular Weight326.79 g/mol
Exact Mass326.09
IUPAC NameN-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide
SMILESO=C(NCC1(c2ccc(Cl)cc2)CC1)c1cnc2cnccn12
InChIInChI=1S/C17H15ClN4O/c18-13-3-1-12(2-4-13)17(5-6-17)11-21-16(23)14-9-20-15-10-19-7-8-22(14)15/h1-4,7-10H,5-6,11H2,(H,21,23)
InChIKeyKLUIVYYTJVNXCC-UHFFFAOYSA-N
XLogP2.84
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.79
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(4-chlorophenyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 113090713
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-2-fluorobenzamide
CID 42265696
4-(aminomethyl)-N-[[1-(4-chlorophenyl)cyclopropyl]methyl]benzamide
CID 119317231
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]thiophene-2-carboxamide
CID 42265711
1-[[1-(4-chlorophenyl)cyclopropyl]methyl]-3-cyclopropylurea
CID 113090728
4-oxo-N-[(1-phenylcyclobutyl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 16614989
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-6-methyl-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 131915045
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide
CID 100906527
2-amino-N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-3-ethylimidazo[4,5-b]pyridine-6-carboxamide
CID 70755416
2-(4-aminophenyl)-N-[[1-(4-chlorophenyl)cyclopropyl]methyl]acetamide;hydrochloride
CID 119772654
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]morpholine-4-carboxamide
CID 113214436
5,6-dichloro-N-[(1-phenylcyclopropyl)methyl]pyridine-3-carboxamide
CID 46462401

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide (CID 171680243) is N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide is O=C(NCC1(c2ccc(Cl)cc2)CC1)c1cnc2cnccn12.
What is the InChIKey of N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is KLUIVYYTJVNXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN4O/c18-13-3-1-12(2-4-13)17(5-6-17)11-21-16(23)14-9-20-15-10-19-7-8-22(14)15/h1-4,7-10H,5-6,11H2,(H,21,23).
What are the key properties of N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide?
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 326.79 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-chlorophenyl)cyclopropyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 171680243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).