2-cyclopropyl-N-(1-phenylethyl)propan-1-amine

C14H21N — CID 115638910

IUPAC2-cyclopropyl-N-(1-phenylethyl)propan-1-amine
SMILESCC(NCC(C)C1CC1)c1ccccc1
InChIInChI=1S/C14H21N/c1-11(13-8-9-13)10-15-12(2)14-6-4-3-5-7-14/h3-7,11-13,15H,8-10H2,1-2H3
InChIKeyYJEORJHYANCUDH-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.38
Rot. Bonds5

About 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine

2-cyclopropyl-N-(1-phenylethyl)propan-1-amine (PubChem CID 115638910) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(1-phenylethyl)propan-1-amine
PubChem CID115638910
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-cyclopropyl-N-(1-phenylethyl)propan-1-amine
SMILESCC(NCC(C)C1CC1)c1ccccc1
InChIInChI=1S/C14H21N/c1-11(13-8-9-13)10-15-12(2)14-6-4-3-5-7-14/h3-7,11-13,15H,8-10H2,1-2H3
InChIKeyYJEORJHYANCUDH-UHFFFAOYSA-N
XLogP3.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopropyl-N-(1-pyridin-4-ylethyl)propan-1-amine
CID 115663663
2-cyclopropyl-N-(1-pyridin-3-ylethyl)propan-1-amine
CID 115623727
N-[1-(2-chlorophenyl)ethyl]-2-cyclopropylpropan-1-amine
CID 115623733
2-cyclopropyl-N-[1-(3-nitrophenyl)ethyl]propan-1-amine
CID 115667947
N-(2-cyclopropylpropyl)-3-phenylbutan-1-amine
CID 113474995
1,3-bis[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 15470316
1,4-bis(1-phenylethylamino)butane-2,3-diol
CID 20833353
(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183
2-ethyl-N-(1-phenylethyl)butan-1-amine
CID 43177121
N-(dicyclopropylmethyl)-2-phenylpropan-1-amine
CID 43204178
N-(1-cyclopropylethyl)-2-phenylbutan-1-amine
CID 115676258

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine (CID 115638910) is 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine is CC(NCC(C)C1CC1)c1ccccc1.
What is the InChIKey of 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine?
The InChIKey is YJEORJHYANCUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11(13-8-9-13)10-15-12(2)14-6-4-3-5-7-14/h3-7,11-13,15H,8-10H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine?
2-cyclopropyl-N-(1-phenylethyl)propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(1-phenylethyl)propan-1-amine is sourced from PubChem (CID 115638910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).