N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C19H16ClN5O — CID 164628067

IUPACN-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCn1cc(-c2ccc3ncc(C(=O)NCc4ccc(Cl)cc4)n3c2)cn1
InChIInChI=1S/C19H16ClN5O/c1-24-11-15(9-23-24)14-4-7-18-21-10-17(25(18)12-14)19(26)22-8-13-2-5-16(20)6-3-13/h2-7,9-12H,8H2,1H3,(H,22,26)
InChIKeyCAUSWAWMBJPGFP-UHFFFAOYSA-N
MW365.82 g/mol
LogP3.32
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 164628067) has the molecular formula C19H16ClN5O and a molecular weight of 365.82 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID164628067
Molecular FormulaC19H16ClN5O
Molecular Weight365.82 g/mol
Exact Mass365.10
IUPAC NameN-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCn1cc(-c2ccc3ncc(C(=O)NCc4ccc(Cl)cc4)n3c2)cn1
InChIInChI=1S/C19H16ClN5O/c1-24-11-15(9-23-24)14-4-7-18-21-10-17(25(18)12-14)19(26)22-8-13-2-5-16(20)6-3-13/h2-7,9-12H,8H2,1H3,(H,22,26)
InChIKeyCAUSWAWMBJPGFP-UHFFFAOYSA-N
XLogP3.32
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 164628067) is N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is Cn1cc(-c2ccc3ncc(C(=O)NCc4ccc(Cl)cc4)n3c2)cn1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is CAUSWAWMBJPGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN5O/c1-24-11-15(9-23-24)14-4-7-18-21-10-17(25(18)12-14)19(26)22-8-13-2-5-16(20)6-3-13/h2-7,9-12H,8H2,1H3,(H,22,26).
What are the key properties of N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 365.82 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 164628067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).