N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide

C22H23FN4O2 — CID 155563114

IUPACN-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(F)cc1C(=O)Nc1nc2ccccn2c1C(=O)NC1CCCCC1
InChIInChI=1S/C22H23FN4O2/c1-14-10-11-15(23)13-17(14)21(28)26-20-19(27-12-6-5-9-18(27)25-20)22(29)24-16-7-3-2-4-8-16/h5-6,9-13,16H,2-4,7-8H2,1H3,(H,24,29)(H,26,28)
InChIKeyLWCSAJYCNYJZAO-UHFFFAOYSA-N
MW394.45 g/mol
LogP4.10
Rot. Bonds4

About N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide

N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 155563114) has the molecular formula C22H23FN4O2 and a molecular weight of 394.45 g/mol. Its IUPAC name is N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID155563114
Molecular FormulaC22H23FN4O2
Molecular Weight394.45 g/mol
Exact Mass394.18
IUPAC NameN-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(F)cc1C(=O)Nc1nc2ccccn2c1C(=O)NC1CCCCC1
InChIInChI=1S/C22H23FN4O2/c1-14-10-11-15(23)13-17(14)21(28)26-20-19(27-12-6-5-9-18(27)25-20)22(29)24-16-7-3-2-4-8-16/h5-6,9-13,16H,2-4,7-8H2,1H3,(H,24,29)(H,26,28)
InChIKeyLWCSAJYCNYJZAO-UHFFFAOYSA-N
XLogP4.10
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide (CID 155563114) is N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(F)cc1C(=O)Nc1nc2ccccn2c1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LWCSAJYCNYJZAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O2/c1-14-10-11-15(23)13-17(14)21(28)26-20-19(27-12-6-5-9-18(27)25-20)22(29)24-16-7-3-2-4-8-16/h5-6,9-13,16H,2-4,7-8H2,1H3,(H,24,29)(H,26,28).
What are the key properties of N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide?
N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 394.45 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(5-fluoro-2-methylbenzoyl)amino]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 155563114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).