N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine

C17H21N5 — CID 138535571

IUPACN-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1[nH]cnc1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C17H21N5/c1-12-15(19-11-18-12)16-17(20-13-7-3-2-4-8-13)22-10-6-5-9-14(22)21-16/h5-6,9-11,13,20H,2-4,7-8H2,1H3,(H,18,19)
InChIKeyPIBKSWXZCKCKNE-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.78
Rot. Bonds3

About N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine

N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 138535571) has the molecular formula C17H21N5 and a molecular weight of 295.39 g/mol. Its IUPAC name is N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine
PubChem CID138535571
Molecular FormulaC17H21N5
Molecular Weight295.39 g/mol
Exact Mass295.18
IUPAC NameN-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1[nH]cnc1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C17H21N5/c1-12-15(19-11-18-12)16-17(20-13-7-3-2-4-8-13)22-10-6-5-9-14(22)21-16/h5-6,9-11,13,20H,2-4,7-8H2,1H3,(H,18,19)
InChIKeyPIBKSWXZCKCKNE-UHFFFAOYSA-N
XLogP3.78
TPSA58.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.78
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-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine (CID 138535571) is N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine is Cc1[nH]cnc1-c1nc2ccccn2c1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is PIBKSWXZCKCKNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5/c1-12-15(19-11-18-12)16-17(20-13-7-3-2-4-8-13)22-10-6-5-9-14(22)21-16/h5-6,9-11,13,20H,2-4,7-8H2,1H3,(H,18,19).
What are the key properties of N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine?
N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 295.39 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(5-methyl-1H-imidazol-4-yl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 138535571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).