N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide

C26H29N3O2 — CID 163772430

IUPACN-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide
SMILESO=C(c1ccc(C(=O)N(CC2CCCCC2)CC2CC2)cc1)c1cnc2ccccn12
InChIInChI=1S/C26H29N3O2/c30-25(23-16-27-24-8-4-5-15-29(23)24)21-11-13-22(14-12-21)26(31)28(18-20-9-10-20)17-19-6-2-1-3-7-19/h4-5,8,11-16,19-20H,1-3,6-7,9-10,17-18H2
InChIKeyMHOZQKJDHIFLKS-UHFFFAOYSA-N
MW415.54 g/mol
LogP5.00
Rot. Bonds7

About N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide

N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide (PubChem CID 163772430) has the molecular formula C26H29N3O2 and a molecular weight of 415.54 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide
PubChem CID163772430
Molecular FormulaC26H29N3O2
Molecular Weight415.54 g/mol
Exact Mass415.23
IUPAC NameN-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide
SMILESO=C(c1ccc(C(=O)N(CC2CCCCC2)CC2CC2)cc1)c1cnc2ccccn12
InChIInChI=1S/C26H29N3O2/c30-25(23-16-27-24-8-4-5-15-29(23)24)21-11-13-22(14-12-21)26(31)28(18-20-9-10-20)17-19-6-2-1-3-7-19/h4-5,8,11-16,19-20H,1-3,6-7,9-10,17-18H2
InChIKeyMHOZQKJDHIFLKS-UHFFFAOYSA-N
XLogP5.00
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.54
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide?
The IUPAC name of N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide (CID 163772430) is N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide is O=C(c1ccc(C(=O)N(CC2CCCCC2)CC2CC2)cc1)c1cnc2ccccn12.
What is the InChIKey of N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide?
The InChIKey is MHOZQKJDHIFLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N3O2/c30-25(23-16-27-24-8-4-5-15-29(23)24)21-11-13-22(14-12-21)26(31)28(18-20-9-10-20)17-19-6-2-1-3-7-19/h4-5,8,11-16,19-20H,1-3,6-7,9-10,17-18H2.
What are the key properties of N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide?
N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide has a molecular weight of 415.54 g/mol, XLogP of 5.00, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-(cyclopropylmethyl)-4-(imidazo[1,2-a]pyridine-3-carbonyl)benzamide is sourced from PubChem (CID 163772430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).