2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine

C14H15N5O — CID 106408059

IUPAC2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine
SMILESNc1ccc2c(c1)nc(C1CC1)n2CCc1ncon1
InChIInChI=1S/C14H15N5O/c15-10-3-4-12-11(7-10)17-14(9-1-2-9)19(12)6-5-13-16-8-20-18-13/h3-4,7-9H,1-2,5-6,15H2
InChIKeyCZADDHUKXKTSAS-UHFFFAOYSA-N
MW269.31 g/mol
LogP2.12
Rot. Bonds4

About 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine

2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine (PubChem CID 106408059) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine
PubChem CID106408059
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine
SMILESNc1ccc2c(c1)nc(C1CC1)n2CCc1ncon1
InChIInChI=1S/C14H15N5O/c15-10-3-4-12-11(7-10)17-14(9-1-2-9)19(12)6-5-13-16-8-20-18-13/h3-4,7-9H,1-2,5-6,15H2
InChIKeyCZADDHUKXKTSAS-UHFFFAOYSA-N
XLogP2.12
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-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

2-cyclopropyl-1-(2-methylsulfanylethyl)benzimidazol-5-amine
CID 63958490
3-(5-amino-2-cyclopropylbenzimidazol-1-yl)propanamide
CID 62507866
2-cyclopropyl-1-(2-piperidin-1-ylethyl)benzimidazol-5-amine
CID 62507722
2-[2-(5-amino-2-cyclopropylbenzimidazol-1-yl)ethoxy]ethanol
CID 62499135
4-(5-amino-2-cyclopropylbenzimidazol-1-yl)butanamide
CID 62508536
5-methoxy-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-2-amine
CID 106406245
2-cyclopropyl-1-(2-propan-2-yloxyethyl)benzimidazol-5-amine
CID 104765893
2-(5-amino-2-cyclopropylbenzimidazol-1-yl)ethyl carbamate
CID 83215207
2-cyclopropyl-1-(2,2-difluoroethyl)benzimidazol-5-amine
CID 113304084
2-cyclopropyl-1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]benzimidazol-5-amine
CID 106376366
2-cyclopropyl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzimidazol-5-amine
CID 79360961
2-cyclopentyl-1-ethylbenzimidazol-5-amine
CID 82391011

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine?
The IUPAC name of 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine (CID 106408059) is 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine.
What is the SMILES notation for 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine?
The canonical SMILES for 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine is Nc1ccc2c(c1)nc(C1CC1)n2CCc1ncon1.
What is the InChIKey of 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine?
The InChIKey is CZADDHUKXKTSAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c15-10-3-4-12-11(7-10)17-14(9-1-2-9)19(12)6-5-13-16-8-20-18-13/h3-4,7-9H,1-2,5-6,15H2.
What are the key properties of 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine?
2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine has a molecular weight of 269.31 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzimidazol-5-amine is sourced from PubChem (CID 106408059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).