8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole

C14H18N2 — CID 115403192

IUPAC8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole
SMILESCCCC1CCc2nc3ccccn3c2C1
InChIInChI=1S/C14H18N2/c1-2-5-11-7-8-12-13(10-11)16-9-4-3-6-14(16)15-12/h3-4,6,9,11H,2,5,7-8,10H2,1H3
InChIKeyIRGSUYDOVSWOKR-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.24
Rot. Bonds2

About 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole

8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole (PubChem CID 115403192) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole.

Molecular Properties

Compound Name8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole
PubChem CID115403192
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole
SMILESCCCC1CCc2nc3ccccn3c2C1
InChIInChI=1S/C14H18N2/c1-2-5-11-7-8-12-13(10-11)16-9-4-3-6-14(16)15-12/h3-4,6,9,11H,2,5,7-8,10H2,1H3
InChIKeyIRGSUYDOVSWOKR-UHFFFAOYSA-N
XLogP3.24
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-propyl-6,7,8,9-tetrahydropyrazino[1,2-a]benzimidazole
CID 104573648
N,N-diethyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200772
N-benzyl-N-ethyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200738
4-propyl-1,4,8-triazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraene
CID 115403178
N-benzyl-N-methyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200730
N-(4-ethoxyphenyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200833
1,5-diazatricyclo[4.4.0.02,4]deca-2(4),5,7,9-tetraene
CID 153452639
N-(4-tert-butylphenyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200813
N-(3,4-dimethylphenyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200799
N-(3-phenylpropyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200773
N-(2,3,4-trifluorophenyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole-8-carboxamide
CID 113200893
4-oxa-1,8-diazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraene
CID 115403194

Frequently Asked Questions

What is the IUPAC name of 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole?
The IUPAC name of 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole (CID 115403192) is 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole.
What is the SMILES notation for 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole?
The canonical SMILES for 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole is CCCC1CCc2nc3ccccn3c2C1.
What is the InChIKey of 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole?
The InChIKey is IRGSUYDOVSWOKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-2-5-11-7-8-12-13(10-11)16-9-4-3-6-14(16)15-12/h3-4,6,9,11H,2,5,7-8,10H2,1H3.
What are the key properties of 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole?
8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole has a molecular weight of 214.31 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propyl-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole is sourced from PubChem (CID 115403192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).