1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine

C19H24FN — CID 63417879

IUPAC1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine
SMILESCCCNC(CCCc1ccccc1)c1ccccc1F
InChIInChI=1S/C19H24FN/c1-2-15-21-19(17-12-6-7-13-18(17)20)14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13,19,21H,2,8,11,14-15H2,1H3
InChIKeyUCKDZGHGWDTDDD-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.89
Rot. Bonds8

About 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine

1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine (PubChem CID 63417879) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine
PubChem CID63417879
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine
SMILESCCCNC(CCCc1ccccc1)c1ccccc1F
InChIInChI=1S/C19H24FN/c1-2-15-21-19(17-12-6-7-13-18(17)20)14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13,19,21H,2,8,11,14-15H2,1H3
InChIKeyUCKDZGHGWDTDDD-UHFFFAOYSA-N
XLogP4.89
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,5,5-trifluoro-1-(2-fluorophenyl)-N-propylpentan-1-amine
CID 115516684
1-(4-bromothiophen-3-yl)-4-phenyl-N-propylbutan-1-amine
CID 105166680
4-(4-chlorophenyl)-1-phenyl-N-propylbutan-1-amine
CID 64502036
1-(2-fluorophenyl)-N'-methyl-N,N'-dipropylpropane-1,3-diamine
CID 62644284
1-(3-chloro-4-pyridinyl)-4-phenyl-N-propylbutan-1-amine
CID 105139865
1-(2,3-difluorophenyl)-N-propylnonan-1-amine
CID 115835811
1-phenyl-N-propyl-4-pyridin-3-ylbutan-1-amine
CID 104737019
1-(4-fluoro-2-methylphenyl)-3-phenyl-N-propylpropan-1-amine
CID 63417221
3-(azepan-1-yl)-1-(2-fluorophenyl)-N-propylpropan-1-amine
CID 62645138
1-(2,2-dimethylcyclopropyl)-4-phenyl-N-propylbutan-1-amine
CID 107004361
1-(2-fluorophenyl)-N-methylpentan-1-amine
CID 63083903
1-(2-chloro-4-fluorophenyl)-3-phenyl-N-propylpropan-1-amine
CID 63420157

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine?
The IUPAC name of 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine (CID 63417879) is 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine?
The canonical SMILES for 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine is CCCNC(CCCc1ccccc1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine?
The InChIKey is UCKDZGHGWDTDDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-2-15-21-19(17-12-6-7-13-18(17)20)14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13,19,21H,2,8,11,14-15H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine?
1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine has a molecular weight of 285.41 g/mol, XLogP of 4.89, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4-phenyl-N-propylbutan-1-amine is sourced from PubChem (CID 63417879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).