1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine

C14H20FN — CID 63355250

IUPAC1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine
SMILESCCNC(CCc1ccccc1F)C1CC1
InChIInChI=1S/C14H20FN/c1-2-16-14(12-7-8-12)10-9-11-5-3-4-6-13(11)15/h3-6,12,14,16H,2,7-10H2,1H3
InChIKeyXOUVPLZCYXMQBN-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.15
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine

1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine (PubChem CID 63355250) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine
PubChem CID63355250
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine
SMILESCCNC(CCc1ccccc1F)C1CC1
InChIInChI=1S/C14H20FN/c1-2-16-14(12-7-8-12)10-9-11-5-3-4-6-13(11)15/h3-6,12,14,16H,2,7-10H2,1H3
InChIKeyXOUVPLZCYXMQBN-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-N-ethyl-3-(2-methoxyphenyl)propan-1-amine
CID 63354961
1-cyclopropyl-3-(2,3-difluoro-4-methylphenyl)-N-ethylpropan-1-amine
CID 107514365
3-(4-chloro-2-fluorophenyl)-1-cyclopentyl-N-ethylpropan-1-amine
CID 114850824
3-(4-chloro-3-fluorophenyl)-1-cyclopropyl-N-ethylpropan-1-amine
CID 107892041
3-cyclopropyl-3-[(2-fluorophenyl)methylamino]propan-1-ol
CID 111457458
1-cyclohexyl-N-ethyl-2-[(2-fluorophenyl)methoxy]ethanamine
CID 104749468
1-(3,4-dimethylcyclohexyl)-N-ethyl-3-(2-methylphenyl)propan-1-amine
CID 105154585
N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine
CID 54891295
1-cyclopentyl-N-ethyl-3-(4-fluoro-2-methylphenyl)propan-1-amine
CID 114346516
1-cyclopropyl-N-ethyl-3-[3-(trifluoromethyl)phenyl]propan-1-amine
CID 55201481
1-cyclopropyl-N-ethyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272541
2-(5-bromo-2-fluorophenyl)-1-cyclopropyl-N-ethylethanamine
CID 62600408

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine (CID 63355250) is 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine is CCNC(CCc1ccccc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine?
The InChIKey is XOUVPLZCYXMQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-2-16-14(12-7-8-12)10-9-11-5-3-4-6-13(11)15/h3-6,12,14,16H,2,7-10H2,1H3.
What are the key properties of 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine?
1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine has a molecular weight of 221.32 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-3-(2-fluorophenyl)propan-1-amine is sourced from PubChem (CID 63355250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).