N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine

C14H19N3 — CID 61387648

IUPACN-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine
SMILESCc1cc2ncn(CCNC3CC3)c2cc1C
InChIInChI=1S/C14H19N3/c1-10-7-13-14(8-11(10)2)17(9-16-13)6-5-15-12-3-4-12/h7-9,12,15H,3-6H2,1-2H3
InChIKeyTXWOFSSXOLVFCJ-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.41
Rot. Bonds4

About N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine

N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine (PubChem CID 61387648) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine
PubChem CID61387648
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine
SMILESCc1cc2ncn(CCNC3CC3)c2cc1C
InChIInChI=1S/C14H19N3/c1-10-7-13-14(8-11(10)2)17(9-16-13)6-5-15-12-3-4-12/h7-9,12,15H,3-6H2,1-2H3
InChIKeyTXWOFSSXOLVFCJ-UHFFFAOYSA-N
XLogP2.41
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine 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

1-cyclopropyl-N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]ethanamine
CID 62563334
N-[4-(5,6-difluorobenzimidazol-1-yl)butyl]cyclopropanamine
CID 62564114
1-(cyclobutylmethyl)-5,6-dimethylbenzimidazole
CID 115761322
N-[2-(1,5,6-trimethylbenzimidazol-2-yl)ethyl]cyclopropanamine
CID 84631024
[5-[(5,6-dimethylbenzimidazol-1-yl)methyl]oxolan-2-yl]methanamine
CID 62447770
5,6-dimethyl-1-nonylbenzimidazole
CID 16994999
(2R)-2-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopentan-1-one
CID 97159914
1-(3-ethylsulfanylpropyl)-5,6-dimethylbenzimidazole
CID 115650935
N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]heptan-2-amine
CID 63502282
3-(5,6-dimethylbenzimidazol-1-yl)propanoic acid;hydrochloride
CID 16615175
1-(2-ethoxyethyl)-5,6-dimethylbenzimidazole;hydrochloride
CID 18593123
N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]-2-thiophen-3-ylethanamine
CID 62564712

Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine?
The IUPAC name of N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine (CID 61387648) is N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine?
The canonical SMILES for N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine is Cc1cc2ncn(CCNC3CC3)c2cc1C.
What is the InChIKey of N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine?
The InChIKey is TXWOFSSXOLVFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10-7-13-14(8-11(10)2)17(9-16-13)6-5-15-12-3-4-12/h7-9,12,15H,3-6H2,1-2H3.
What are the key properties of N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine?
N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine has a molecular weight of 229.33 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6-dimethylbenzimidazol-1-yl)ethyl]cyclopropanamine is sourced from PubChem (CID 61387648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).