2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine

C15H21N3 — CID 114029101

IUPAC2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine
SMILESCCCn1ccnc1C(N)C(C)c1ccccc1
InChIInChI=1S/C15H21N3/c1-3-10-18-11-9-17-15(18)14(16)12(2)13-7-5-4-6-8-13/h4-9,11-12,14H,3,10,16H2,1-2H3
InChIKeyBIINQUWROIAIOY-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.10
Rot. Bonds5

About 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine

2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine (PubChem CID 114029101) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine
PubChem CID114029101
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine
SMILESCCCn1ccnc1C(N)C(C)c1ccccc1
InChIInChI=1S/C15H21N3/c1-3-10-18-11-9-17-15(18)14(16)12(2)13-7-5-4-6-8-13/h4-9,11-12,14H,3,10,16H2,1-2H3
InChIKeyBIINQUWROIAIOY-UHFFFAOYSA-N
XLogP3.10
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylsulfonyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 115858993
2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 63975212
2-(2-fluorophenyl)sulfanyl-1-(1-propylimidazol-2-yl)ethanamine
CID 66052890
(1-propylimidazol-2-yl)-[3-(trifluoromethyl)phenyl]methanamine
CID 61316673
(1-propylimidazol-2-yl)-quinoxalin-5-ylmethanamine
CID 104615599
1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol
CID 63977142
3-methyl-1-(1-methylimidazol-2-yl)-2-phenylpentan-1-amine
CID 115580068
(1-propylimidazol-2-yl)-pyridin-3-ylmethanol
CID 61315543
(2-chlorofuran-3-yl)-(1-propylimidazol-2-yl)methanamine
CID 106689402
[(3-bromophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105197993
[2,2-difluoro-1-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105265098
N-methyl-1-(1-propylimidazol-2-yl)-1-pyridin-3-ylmethanamine
CID 61318146

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine?
The IUPAC name of 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine (CID 114029101) is 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine.
What is the SMILES notation for 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine?
The canonical SMILES for 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine is CCCn1ccnc1C(N)C(C)c1ccccc1.
What is the InChIKey of 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine?
The InChIKey is BIINQUWROIAIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-3-10-18-11-9-17-15(18)14(16)12(2)13-7-5-4-6-8-13/h4-9,11-12,14H,3,10,16H2,1-2H3.
What are the key properties of 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine?
2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine is sourced from PubChem (CID 114029101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).