5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one

C15H23N3O — CID 43496018

IUPAC5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one
SMILESCCCCC(NCCC)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H23N3O/c1-3-5-6-12(16-9-4-2)11-7-8-13-14(10-11)18-15(19)17-13/h7-8,10,12,16H,3-6,9H2,1-2H3,(H2,17,18,19)
InChIKeyOWNODBSSSNHDQN-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.09
Rot. Bonds7

About 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one

5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one (PubChem CID 43496018) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one.

Molecular Properties

Compound Name5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one
PubChem CID43496018
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one
SMILESCCCCC(NCCC)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H23N3O/c1-3-5-6-12(16-9-4-2)11-7-8-13-14(10-11)18-15(19)17-13/h7-8,10,12,16H,3-6,9H2,1-2H3,(H2,17,18,19)
InChIKeyOWNODBSSSNHDQN-UHFFFAOYSA-N
XLogP3.09
TPSA60.68 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one with MolForge

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

Launch Full Analysis

Related Compounds

6-[1-(propylamino)butyl]-1,4-dihydroquinoxaline-2,3-dione
CID 43495871
5-[2,2-dimethyl-1-(propylamino)butyl]-1,3-dihydrobenzimidazol-2-one
CID 62679554
5-(1-bromo-2-ethylhexyl)-1,3-dihydrobenzimidazol-2-one
CID 63442237
6-[1-(propylamino)pentyl]-4H-1,4-benzoxazin-3-one
CID 43497611
5-[propylamino(thiophen-2-yl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 43496016
6-[1-(propylamino)ethyl]-1,4-dihydroquinoxaline-2,3-dione
CID 43495873
5-[(5-bromofuran-2-yl)-(propylamino)methyl]-1,3-dihydrobenzimidazol-2-one
CID 43496013
5-[3-(2,2-difluoroethoxy)-1-(ethylamino)propyl]-1,3-dihydrobenzimidazol-2-one
CID 103207310
1-(3-bromo-4-chlorophenyl)-N-propylpentan-1-amine
CID 115567747
5-[1-(ethylamino)-2-phenylethyl]-1,3-dihydrobenzimidazol-2-one
CID 43490689
5-[oxolan-3-yl(propylamino)methyl]-1,3-dihydrobenzimidazol-2-one
CID 61276462
1-(2-methyl-4-pyridinyl)-N-propyloctan-1-amine
CID 106755069

Frequently Asked Questions

What is the IUPAC name of 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one?
The IUPAC name of 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one (CID 43496018) is 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one.
What is the SMILES notation for 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one?
The canonical SMILES for 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one is CCCCC(NCCC)c1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one?
The InChIKey is OWNODBSSSNHDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-5-6-12(16-9-4-2)11-7-8-13-14(10-11)18-15(19)17-13/h7-8,10,12,16H,3-6,9H2,1-2H3,(H2,17,18,19).
What are the key properties of 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one?
5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one has a molecular weight of 261.37 g/mol, XLogP of 3.09, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(propylamino)pentyl]-1,3-dihydrobenzimidazol-2-one is sourced from PubChem (CID 43496018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).