N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine

C19H22N4O — CID 145386113

IUPACN-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine
SMILESCOc1ccc(Nc2cc(-c3c(C)nc4n3CCCC4)c[nH]2)cc1
InChIInChI=1S/C19H22N4O/c1-13-19(23-10-4-3-5-18(23)21-13)14-11-17(20-12-14)22-15-6-8-16(24-2)9-7-15/h6-9,11-12,20,22H,3-5,10H2,1-2H3
InChIKeyLPEWRBXBMKVKCR-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.28
Rot. Bonds4

About N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine

N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine (PubChem CID 145386113) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine
PubChem CID145386113
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine
SMILESCOc1ccc(Nc2cc(-c3c(C)nc4n3CCCC4)c[nH]2)cc1
InChIInChI=1S/C19H22N4O/c1-13-19(23-10-4-3-5-18(23)21-13)14-11-17(20-12-14)22-15-6-8-16(24-2)9-7-15/h6-9,11-12,20,22H,3-5,10H2,1-2H3
InChIKeyLPEWRBXBMKVKCR-UHFFFAOYSA-N
XLogP4.28
TPSA54.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine?
The IUPAC name of N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine (CID 145386113) is N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine?
The canonical SMILES for N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine is COc1ccc(Nc2cc(-c3c(C)nc4n3CCCC4)c[nH]2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine?
The InChIKey is LPEWRBXBMKVKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-13-19(23-10-4-3-5-18(23)21-13)14-11-17(20-12-14)22-15-6-8-16(24-2)9-7-15/h6-9,11-12,20,22H,3-5,10H2,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine?
N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine has a molecular weight of 322.41 g/mol, XLogP of 4.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-pyrrol-2-amine is sourced from PubChem (CID 145386113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).