1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine

C14H19N3 — CID 43655424

IUPAC1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
SMILESCCn1c(CNCC2CC2)nc2ccccc21
InChIInChI=1S/C14H19N3/c1-2-17-13-6-4-3-5-12(13)16-14(17)10-15-9-11-7-8-11/h3-6,11,15H,2,7-10H2,1H3
InChIKeyOKSFOMVWPQZOIG-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.56
Rot. Bonds5

About 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine

1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine (PubChem CID 43655424) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
PubChem CID43655424
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
SMILESCCn1c(CNCC2CC2)nc2ccccc21
InChIInChI=1S/C14H19N3/c1-2-17-13-6-4-3-5-12(13)16-14(17)10-15-9-11-7-8-11/h3-6,11,15H,2,7-10H2,1H3
InChIKeyOKSFOMVWPQZOIG-UHFFFAOYSA-N
XLogP2.56
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethylbenzimidazol-2-yl)methyl]-1-(3-methylcyclopentyl)methanamine
CID 107411845
N-[(1-ethylbenzimidazol-2-yl)methyl]-1-[(2R)-oxolan-2-yl]methanamine
CID 93418668
1-(2-bicyclo[2.2.1]heptanyl)-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
CID 62734834
1-(1,1-dioxothiolan-2-yl)-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine
CID 81043351
1-(1-ethylpiperidin-4-yl)-N-[(1-methylbenzimidazol-2-yl)methyl]methanamine
CID 63378932
N-[(1-tert-butylbenzimidazol-2-yl)methyl]-1-cyclopropylmethanamine
CID 43655437
2-[2-[(1-ethylbenzimidazol-2-yl)methylamino]ethoxy]ethanol
CID 54906324
N-[(1-ethylbenzimidazol-2-yl)methyl]cyclopropanecarboxamide
CID 16969775
2-[(1-ethylbenzimidazol-2-yl)methylamino]-N-methylacetamide
CID 60673139
3-[(1-ethylbenzimidazol-2-yl)methyl]cyclopentan-1-ol
CID 79750884
(1-ethylbenzimidazol-2-yl)methylhydrazine
CID 53275104
N-[(1-ethylbenzimidazol-2-yl)methyl]-2,2-difluoroethanamine
CID 113303573

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine (CID 43655424) is 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine is CCn1c(CNCC2CC2)nc2ccccc21.
What is the InChIKey of 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine?
The InChIKey is OKSFOMVWPQZOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-2-17-13-6-4-3-5-12(13)16-14(17)10-15-9-11-7-8-11/h3-6,11,15H,2,7-10H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine?
1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine has a molecular weight of 229.33 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1-ethylbenzimidazol-2-yl)methyl]methanamine is sourced from PubChem (CID 43655424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).