1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine

C12H15N3 — CID 43142730

IUPAC1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine
SMILESCNCc1nc2ccccc2n1C1CC1
InChIInChI=1S/C12H15N3/c1-13-8-12-14-10-4-2-3-5-11(10)15(12)9-6-7-9/h2-5,9,13H,6-8H2,1H3
InChIKeyIIAVHZQHJRBATG-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.09
Rot. Bonds3

About 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine

1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine (PubChem CID 43142730) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine
PubChem CID43142730
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine
SMILESCNCc1nc2ccccc2n1C1CC1
InChIInChI=1S/C12H15N3/c1-13-8-12-14-10-4-2-3-5-11(10)15(12)9-6-7-9/h2-5,9,13H,6-8H2,1H3
InChIKeyIIAVHZQHJRBATG-UHFFFAOYSA-N
XLogP2.09
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)-N-methylmethanamine
CID 60785108
1-[(1-cyclopropylbenzimidazol-2-yl)methyl]-3-propylurea
CID 110747246
1-cyclopropyl-N-methylbenzimidazol-2-amine
CID 21043921
1-[(1-cyclopropylbenzimidazol-2-yl)methyl]-N-methylcyclohexan-1-amine
CID 65243114
2-chloro-N-[(1-cyclopropylbenzimidazol-2-yl)methyl]acetamide;hydrochloride
CID 146089283
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-2-(2-methylphenyl)acetamide
CID 110712126
2-(chloromethyl)-1-cyclobutylbenzimidazole
CID 62416767
2-(2-chloroethyl)-1-(4-methylcyclohexyl)benzimidazole
CID 43666622
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 133466685
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-2-methyl-1H-pyrrole-3-carboxamide
CID 154793757
3-[(1-cyclopropylbenzimidazol-2-yl)methylamino]-1-ethylpyrazin-2-one
CID 133466705
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]-2-(4-fluorophenyl)acetamide
CID 110712099

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine (CID 43142730) is 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine is CNCc1nc2ccccc2n1C1CC1.
What is the InChIKey of 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine?
The InChIKey is IIAVHZQHJRBATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-13-8-12-14-10-4-2-3-5-11(10)15(12)9-6-7-9/h2-5,9,13H,6-8H2,1H3.
What are the key properties of 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine?
1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine has a molecular weight of 201.27 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylbenzimidazol-2-yl)-N-methylmethanamine is sourced from PubChem (CID 43142730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).