N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine

C15H19N3 — CID 63975192

IUPACN-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine
SMILESCCn1ccnc1-c1cccc(CNC2CC2)c1
InChIInChI=1S/C15H19N3/c1-2-18-9-8-16-15(18)13-5-3-4-12(10-13)11-17-14-6-7-14/h3-5,8-10,14,17H,2,6-7,11H2,1H3
InChIKeyUNJAOMJSOZOQSL-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.82
Rot. Bonds5

About N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine

N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine (PubChem CID 63975192) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine
PubChem CID63975192
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine
SMILESCCn1ccnc1-c1cccc(CNC2CC2)c1
InChIInChI=1S/C15H19N3/c1-2-18-9-8-16-15(18)13-5-3-4-12(10-13)11-17-14-6-7-14/h3-5,8-10,14,17H,2,6-7,11H2,1H3
InChIKeyUNJAOMJSOZOQSL-UHFFFAOYSA-N
XLogP2.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine
CID 63974152
N-[[3-[2-(2-methylimidazol-1-yl)ethoxy]phenyl]methyl]cyclopropanamine
CID 61493252
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
N-[[3-(3,5-dimethylphenyl)phenyl]methyl]cyclopropanamine
CID 54912714
N-[[2-fluoro-5-(1-propylimidazol-2-yl)phenyl]methyl]cyclopropanamine
CID 63975818
N-[[3-methyl-4-[(1-propylimidazol-2-yl)methyl]phenyl]methyl]cyclopropanamine
CID 79739257
3-[4-[(3-ethoxyphenyl)methylamino]piperidin-1-yl]-1-ethylpyrazin-2-one
CID 128976328
N-[[3-chloro-4-[(1-ethylimidazol-2-yl)methoxy]phenyl]methyl]cyclopropanamine
CID 62737898
[3-(1-propylimidazol-2-yl)phenyl]methanamine
CID 63974354
N-methyl-1-[3-(1-methylimidazol-2-yl)phenyl]methanamine
CID 58113407
N-[(1-ethylimidazol-2-yl)methyl]-1-(3-methylphenyl)methanamine
CID 62357739
N-[[1-[(3-methoxyphenyl)methyl]imidazol-2-yl]methyl]cyclopropanamine
CID 42818895

Frequently Asked Questions

What is the IUPAC name of N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine (CID 63975192) is N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine is CCn1ccnc1-c1cccc(CNC2CC2)c1.
What is the InChIKey of N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine?
The InChIKey is UNJAOMJSOZOQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-2-18-9-8-16-15(18)13-5-3-4-12(10-13)11-17-14-6-7-14/h3-5,8-10,14,17H,2,6-7,11H2,1H3.
What are the key properties of N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine?
N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine has a molecular weight of 241.34 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(1-ethylimidazol-2-yl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 63975192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).