6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

C19H30N4O3 — CID 155872222

IUPAC6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
SMILESCCOCCCNC(=O)c1ncn2c1CCC(C(=O)NC1CCCC1)C2
InChIInChI=1S/C19H30N4O3/c1-2-26-11-5-10-20-19(25)17-16-9-8-14(12-23(16)13-21-17)18(24)22-15-6-3-4-7-15/h13-15H,2-12H2,1H3,(H,20,25)(H,22,24)
InChIKeyFOJBSPOFSWZOGC-UHFFFAOYSA-N
MW362.47 g/mol
LogP1.66
Rot. Bonds8

About 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (PubChem CID 155872222) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

Molecular Properties

Compound Name6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
PubChem CID155872222
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC Name6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
SMILESCCOCCCNC(=O)c1ncn2c1CCC(C(=O)NC1CCCC1)C2
InChIInChI=1S/C19H30N4O3/c1-2-26-11-5-10-20-19(25)17-16-9-8-14(12-23(16)13-21-17)18(24)22-15-6-3-4-7-15/h13-15H,2-12H2,1H3,(H,20,25)(H,22,24)
InChIKeyFOJBSPOFSWZOGC-UHFFFAOYSA-N
XLogP1.66
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-N-cyclobutyl-1-N-propyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872544
1-N-cyclopentyl-6-N-(2-methoxyethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872435
6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872322
6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155879102
1-N-(3-methoxypropyl)-6-N-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872089
1-N-cyclopropyl-6-N-(cyclopropylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872068
6-N-cyclobutyl-1-N,1-N-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155879426
1-N-butyl-6-N-(cyclopropylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide;formic acid
CID 155872404
N-cyclopentyl-1-(4-methylpiperazine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 155872449
N-cyclopentyl-1-(4-hydroxypiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 155871661
1-N-(2-methylbutyl)-6-N-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155870992
1-N,1-N-diethyl-6-N-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
CID 155872091

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The IUPAC name of 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (CID 155872222) is 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.
What is the SMILES notation for 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The canonical SMILES for 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is CCOCCCNC(=O)c1ncn2c1CCC(C(=O)NC1CCCC1)C2.
What is the InChIKey of 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The InChIKey is FOJBSPOFSWZOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-2-26-11-5-10-20-19(25)17-16-9-8-14(12-23(16)13-21-17)18(24)22-15-6-3-4-7-15/h13-15H,2-12H2,1H3,(H,20,25)(H,22,24).
What are the key properties of 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide has a molecular weight of 362.47 g/mol, XLogP of 1.66, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopentyl-1-N-(3-ethoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is sourced from PubChem (CID 155872222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).