2-methyl-1-(4-propylphenyl)prop-1-en-1-amine

C13H19N — CID 170745986

IUPAC2-methyl-1-(4-propylphenyl)prop-1-en-1-amine
SMILESCCCc1ccc(C(N)=C(C)C)cc1
InChIInChI=1S/C13H19N/c1-4-5-11-6-8-12(9-7-11)13(14)10(2)3/h6-9H,4-5,14H2,1-3H3
InChIKeyMCPTUZMRIOVSPG-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.35
Rot. Bonds3

About 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine

2-methyl-1-(4-propylphenyl)prop-1-en-1-amine (PubChem CID 170745986) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine.

Molecular Properties

Compound Name2-methyl-1-(4-propylphenyl)prop-1-en-1-amine
PubChem CID170745986
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name2-methyl-1-(4-propylphenyl)prop-1-en-1-amine
SMILESCCCc1ccc(C(N)=C(C)C)cc1
InChIInChI=1S/C13H19N/c1-4-5-11-6-8-12(9-7-11)13(14)10(2)3/h6-9H,4-5,14H2,1-3H3
InChIKeyMCPTUZMRIOVSPG-UHFFFAOYSA-N
XLogP3.35
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-prop-1-en-2-yl-4-[(4-propylphenyl)methyl]benzene
CID 153374408
1-(1-phenylprop-1-en-2-yl)-4-propylbenzene
CID 57256038
acetamide;propylbenzene
CID 142238516
3-(4-propylphenyl)propanethioamide
CID 83921535
ethane;4-propylbenzoic acid
CID 91047964
(Z)-N-methoxy-1-(4-propylphenyl)ethanimine
CID 90777265
cadmium(2+);bis(4-propylbenzoate)
CID 101299923
1-propyl-4-[(4-propylphenyl)methyl]benzene
CID 4064340
ethyl 2-oxo-2-(4-propylphenyl)acetate
CID 2758899
3-(4-propylphenyl)but-2-enenitrile
CID 76913920
4-(4-propylphenyl)butanethioamide
CID 83921539
N'-hydroxy-4-propylbenzohydrazide
CID 18359035

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine?
The IUPAC name of 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine (CID 170745986) is 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine.
What is the SMILES notation for 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine?
The canonical SMILES for 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine is CCCc1ccc(C(N)=C(C)C)cc1.
What is the InChIKey of 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine?
The InChIKey is MCPTUZMRIOVSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-4-5-11-6-8-12(9-7-11)13(14)10(2)3/h6-9H,4-5,14H2,1-3H3.
What are the key properties of 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine?
2-methyl-1-(4-propylphenyl)prop-1-en-1-amine has a molecular weight of 189.30 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-propylphenyl)prop-1-en-1-amine is sourced from PubChem (CID 170745986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).