[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine

C13H17N3 — CID 117307056

IUPAC[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine
SMILESNCC1(c2cccc(N3C=NCC3)c2)CC1
InChIInChI=1S/C13H17N3/c14-9-13(4-5-13)11-2-1-3-12(8-11)16-7-6-15-10-16/h1-3,8,10H,4-7,9,14H2
InChIKeyMTBOZWRORVRYBP-UHFFFAOYSA-N
MW215.30 g/mol
LogP1.53
Rot. Bonds3

About [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine

[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine (PubChem CID 117307056) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine
PubChem CID117307056
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine
SMILESNCC1(c2cccc(N3C=NCC3)c2)CC1
InChIInChI=1S/C13H17N3/c14-9-13(4-5-13)11-2-1-3-12(8-11)16-7-6-15-10-16/h1-3,8,10H,4-7,9,14H2
InChIKeyMTBOZWRORVRYBP-UHFFFAOYSA-N
XLogP1.53
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine 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-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclobutyl]methanamine
CID 117331103
1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopentane-1-carboxylic acid
CID 117399453
O-[2-[3-(4,5-dihydroimidazol-1-yl)phenyl]ethyl]hydroxylamine
CID 117293696
3-[3-(4,5-dihydroimidazol-1-yl)phenyl]propanal
CID 117290888
2-[3-(4,5-dihydroimidazol-1-yl)phenyl]propan-2-amine
CID 117291997
[1-[2-(4,5-dihydroimidazol-1-yl)phenyl]cyclobutyl]methanamine
CID 117331102
3-[1-(aminomethyl)cyclopropyl]aniline
CID 82275301
[1-[3-[1-(aminomethyl)cyclopropyl]phenyl]cyclopropyl]methanol
CID 117112180
[1-[3-(1,2,4-triazol-1-yl)phenyl]cyclohexyl]methanamine
CID 117394631
2-[3-(4,5-dihydroimidazol-1-yl)phenyl]-2-oxoacetic acid
CID 117310592
1-[3-[1-(aminomethyl)cyclopropyl]phenyl]-3-propan-2-ylimidazol-2-one
CID 117431456
4-[3-(4,5-dihydroimidazol-1-yl)phenyl]butanoic acid
CID 117336301

Frequently Asked Questions

What is the IUPAC name of [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine?
The IUPAC name of [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine (CID 117307056) is [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine?
The canonical SMILES for [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine is NCC1(c2cccc(N3C=NCC3)c2)CC1.
What is the InChIKey of [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine?
The InChIKey is MTBOZWRORVRYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c14-9-13(4-5-13)11-2-1-3-12(8-11)16-7-6-15-10-16/h1-3,8,10H,4-7,9,14H2.
What are the key properties of [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine?
[1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine has a molecular weight of 215.30 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(4,5-dihydroimidazol-1-yl)phenyl]cyclopropyl]methanamine is sourced from PubChem (CID 117307056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).