2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide

C18H27N5O2 — CID 71932688

IUPAC2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide
SMILESCn1c(C2CC2)nc2c1CCN(CC(=O)NC1CCCCNC1=O)C2
InChIInChI=1S/C18H27N5O2/c1-22-15-7-9-23(10-14(15)21-17(22)12-5-6-12)11-16(24)20-13-4-2-3-8-19-18(13)25/h12-13H,2-11H2,1H3,(H,19,25)(H,20,24)
InChIKeyRJLMIEZEFHZMRQ-UHFFFAOYSA-N
MW345.45 g/mol
LogP0.44
Rot. Bonds4

About 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide

2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide (PubChem CID 71932688) has the molecular formula C18H27N5O2 and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide
PubChem CID71932688
Molecular FormulaC18H27N5O2
Molecular Weight345.45 g/mol
Exact Mass345.22
IUPAC Name2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide
SMILESCn1c(C2CC2)nc2c1CCN(CC(=O)NC1CCCCNC1=O)C2
InChIInChI=1S/C18H27N5O2/c1-22-15-7-9-23(10-14(15)21-17(22)12-5-6-12)11-16(24)20-13-4-2-3-8-19-18(13)25/h12-13H,2-11H2,1H3,(H,19,25)(H,20,24)
InChIKeyRJLMIEZEFHZMRQ-UHFFFAOYSA-N
XLogP0.44
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide 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 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide?
The IUPAC name of 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide (CID 71932688) is 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide.
What is the SMILES notation for 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide?
The canonical SMILES for 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide is Cn1c(C2CC2)nc2c1CCN(CC(=O)NC1CCCCNC1=O)C2.
What is the InChIKey of 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide?
The InChIKey is RJLMIEZEFHZMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O2/c1-22-15-7-9-23(10-14(15)21-17(22)12-5-6-12)11-16(24)20-13-4-2-3-8-19-18(13)25/h12-13H,2-11H2,1H3,(H,19,25)(H,20,24).
What are the key properties of 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide?
2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide has a molecular weight of 345.45 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-oxoazepan-3-yl)acetamide is sourced from PubChem (CID 71932688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).