N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine

C15H23N3 — CID 60834225

IUPACN-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1nc2ccccc2n1C(C)C
InChIInChI=1S/C15H23N3/c1-11(2)16-10-9-15-17-13-7-5-6-8-14(13)18(15)12(3)4/h5-8,11-12,16H,9-10H2,1-4H3
InChIKeyASALCEHWHMVQQL-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.16
Rot. Bonds5

About N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine

N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine (PubChem CID 60834225) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine
PubChem CID60834225
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1nc2ccccc2n1C(C)C
InChIInChI=1S/C15H23N3/c1-11(2)16-10-9-15-17-13-7-5-6-8-14(13)18(15)12(3)4/h5-8,11-12,16H,9-10H2,1-4H3
InChIKeyASALCEHWHMVQQL-UHFFFAOYSA-N
XLogP3.16
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-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

Related Compounds

N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]aniline
CID 60835042
N-methyl-3-(1-propan-2-ylbenzimidazol-2-yl)propan-1-amine
CID 43152019
N,N-dimethyl-3-(1-propan-2-ylbenzimidazol-2-yl)propan-1-amine
CID 170866849
1-(1-propan-2-ylbenzimidazol-2-yl)propan-2-amine
CID 43171099
N-[(1-propan-2-ylbenzimidazol-2-yl)methyl]aniline
CID 60835044
(3S)-N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]-3-pyrrol-1-ylbutanamide
CID 95773068
2-(1-propan-2-ylbenzimidazol-2-yl)acetonitrile
CID 55247145
3-methyl-N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]benzamide
CID 4106595
N-[(1-propan-2-ylbenzimidazol-2-yl)methyl]acetamide
CID 751074
N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119888858
N-propan-2-yl-3-(2-propylbenzimidazol-1-yl)propan-1-amine
CID 112632150
2-methyl-6-oxo-N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 122150093

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine (CID 60834225) is N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine is CC(C)NCCc1nc2ccccc2n1C(C)C.
What is the InChIKey of N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine?
The InChIKey is ASALCEHWHMVQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-11(2)16-10-9-15-17-13-7-5-6-8-14(13)18(15)12(3)4/h5-8,11-12,16H,9-10H2,1-4H3.
What are the key properties of N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine?
N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine has a molecular weight of 245.37 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]propan-2-amine is sourced from PubChem (CID 60834225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).