N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine

C15H19N3 — CID 24715628

IUPACN-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine
SMILESc1ccc(Cn2ccnc2CNCC2CC2)cc1
InChIInChI=1S/C15H19N3/c1-2-4-14(5-3-1)12-18-9-8-17-15(18)11-16-10-13-6-7-13/h1-5,8-9,13,16H,6-7,10-12H2
InChIKeyXUMWIYOAXIDBGD-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.43
Rot. Bonds6

About N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine

N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine (PubChem CID 24715628) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine.

Molecular Properties

Compound NameN-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine
PubChem CID24715628
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine
SMILESc1ccc(Cn2ccnc2CNCC2CC2)cc1
InChIInChI=1S/C15H19N3/c1-2-4-14(5-3-1)12-18-9-8-17-15(18)11-16-10-13-6-7-13/h1-5,8-9,13,16H,6-7,10-12H2
InChIKeyXUMWIYOAXIDBGD-UHFFFAOYSA-N
XLogP2.43
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-benzylimidazol-2-yl)methyl]-1-[(6R)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 95750218
1-cyclopropyl-N-[[1-[(3-methoxyphenyl)methyl]imidazol-2-yl]methyl]methanamine
CID 24715482
N-[(1-benzylimidazol-2-yl)methyl]ethanamine;hydrochloride
CID 45156296
N'-[(1-benzylimidazol-2-yl)methyl]-N-[2-[(1-benzylimidazol-2-yl)methylamino]ethyl]ethane-1,2-diamine
CID 57206578
2-(cyclopropylmethylamino)-N-[[1-(2-phenylethyl)imidazol-2-yl]methyl]acetamide;dihydrochloride
CID 119898678
2-[(1-benzylimidazol-2-yl)methyl]-1-(cyclobutylmethyl)guanidine;hydroiodide
CID 111817215
1-[(1-benzylimidazol-2-yl)methyl]piperidin-4-ol
CID 110887635
4-[[(1-ethylimidazol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 106126176
N-[(1-benzylimidazol-2-yl)methyl]-N-(cyclopropylmethyl)cyclopropanecarboxamide
CID 42818873
1-[(1-benzylimidazol-2-yl)methylamino]-2,2-dimethylpropan-1-ol
CID 135256386
N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropyl-1-(4-fluorophenyl)methanamine
CID 71931133
(1-benzylimidazol-2-yl)methanamine;dihydrochloride
CID 13478012

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine?
The IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine (CID 24715628) is N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine.
What is the SMILES notation for N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine?
The canonical SMILES for N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine is c1ccc(Cn2ccnc2CNCC2CC2)cc1.
What is the InChIKey of N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine?
The InChIKey is XUMWIYOAXIDBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-2-4-14(5-3-1)12-18-9-8-17-15(18)11-16-10-13-6-7-13/h1-5,8-9,13,16H,6-7,10-12H2.
What are the key properties of N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine?
N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine has a molecular weight of 241.34 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylimidazol-2-yl)methyl]-1-cyclopropylmethanamine is sourced from PubChem (CID 24715628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).