1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine

C15H22FN — CID 62995406

IUPAC1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine
SMILESCC(Cc1ccc(F)cc1)NC(C)C1(C)CC1
InChIInChI=1S/C15H22FN/c1-11(17-12(2)15(3)8-9-15)10-13-4-6-14(16)7-5-13/h4-7,11-12,17H,8-10H2,1-3H3
InChIKeyPNIIAXUVIWJQDZ-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.53
Rot. Bonds5

About 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine

1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine (PubChem CID 62995406) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine
PubChem CID62995406
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Name1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine
SMILESCC(Cc1ccc(F)cc1)NC(C)C1(C)CC1
InChIInChI=1S/C15H22FN/c1-11(17-12(2)15(3)8-9-15)10-13-4-6-14(16)7-5-13/h4-7,11-12,17H,8-10H2,1-3H3
InChIKeyPNIIAXUVIWJQDZ-UHFFFAOYSA-N
XLogP3.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(1-methylcyclopropyl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 61473217
N-[2-(4-fluorophenyl)ethyl]-1-(1-methylcyclopropyl)ethanamine
CID 43363099
N-[(1S)-1-cyclopentylethyl]-1-(4-fluorophenyl)propan-2-amine
CID 104979804
1-(4-fluorophenyl)-N-[(1-propan-2-ylcyclopropyl)methyl]propan-2-amine
CID 113348787
N-[1-(4-fluorophenyl)propan-2-yl]-4-methylpiperidine-4-carboxamide
CID 63122933
1-(furan-2-yl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine
CID 43693033
N-[1-(3,4-difluorophenyl)ethyl]-1-(4-fluorophenyl)propan-2-amine
CID 63008182
1-(4-fluorophenyl)-N-[1-(4-methylphenyl)ethyl]propan-2-amine
CID 63008352
1-[[1-(4-fluorophenyl)propan-2-ylamino]methyl]cyclohexan-1-ol
CID 55152835
N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
CID 115894801
1-(2,4-difluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]ethanamine
CID 43680827
1-(4-bromophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-2-amine
CID 43695926

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine (CID 62995406) is 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine is CC(Cc1ccc(F)cc1)NC(C)C1(C)CC1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine?
The InChIKey is PNIIAXUVIWJQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-11(17-12(2)15(3)8-9-15)10-13-4-6-14(16)7-5-13/h4-7,11-12,17H,8-10H2,1-3H3.
What are the key properties of 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine?
1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine has a molecular weight of 235.35 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine is sourced from PubChem (CID 62995406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).