3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine

C15H21N — CID 79977685

IUPAC3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine
SMILESCC(C)NCC=Cc1ccc(C2CC2)cc1
InChIInChI=1S/C15H21N/c1-12(2)16-11-3-4-13-5-7-14(8-6-13)15-9-10-15/h3-8,12,15-16H,9-11H2,1-2H3
InChIKeyHONBCTIDZKGMSH-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.58
Rot. Bonds5

About 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine

3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine (PubChem CID 79977685) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine
PubChem CID79977685
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine
SMILESCC(C)NCC=Cc1ccc(C2CC2)cc1
InChIInChI=1S/C15H21N/c1-12(2)16-11-3-4-13-5-7-14(8-6-13)15-9-10-15/h3-8,12,15-16H,9-11H2,1-2H3
InChIKeyHONBCTIDZKGMSH-UHFFFAOYSA-N
XLogP3.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-phenyl-N-propan-2-ylprop-2-en-1-amine
CID 54218883
N-[(4-cyclopropylphenyl)methyl]propan-2-amine
CID 62491335
(E)-N-(1-cyclopropylethyl)-3-(4-fluorophenyl)prop-2-en-1-amine
CID 115751536
1-[(E)-but-1-enyl]-4-[4-(4-fluorocyclohexyl)phenyl]benzene
CID 22123888
3-(3-bromo-4-fluorophenyl)-N-propan-2-ylprop-2-en-1-amine
CID 79347279
1-(4-fluorocyclohexyl)-4-[4-[(E)-pent-1-enyl]phenyl]benzene
CID 22123950
N-[(4-cyclopropyl-2-fluorophenyl)methyl]propan-2-amine
CID 62490162
N-[3-(4-propan-2-ylphenyl)prop-2-enyl]cyclopropanamine
CID 79348162
1-[(E)-but-1-enyl]-4-[2-[4-(4-fluorocyclohexyl)phenyl]ethynyl]benzene
CID 139729983
1-cyclohexyl-4-[4-(4-cyclopentylphenyl)buta-1,3-dienyl]benzene
CID 173393354
1-[(Z)-1,2-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]ethenyl]-4-(4-propylcyclohexyl)benzene
CID 67699851
1-[2-(bromomethyl)-3-methylbut-1-enyl]-4-cyclopropylbenzene
CID 79976856

Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine?
The IUPAC name of 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine (CID 79977685) is 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine.
What is the SMILES notation for 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine?
The canonical SMILES for 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine is CC(C)NCC=Cc1ccc(C2CC2)cc1.
What is the InChIKey of 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine?
The InChIKey is HONBCTIDZKGMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-12(2)16-11-3-4-13-5-7-14(8-6-13)15-9-10-15/h3-8,12,15-16H,9-11H2,1-2H3.
What are the key properties of 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine?
3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine has a molecular weight of 215.34 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclopropylphenyl)-N-propan-2-ylprop-2-en-1-amine is sourced from PubChem (CID 79977685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).