2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine

C12H15N — CID 134356693

IUPAC2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine
SMILESC=C(C)NCC(=C)c1ccccc1
InChIInChI=1S/C12H15N/c1-10(2)13-9-11(3)12-7-5-4-6-8-12/h4-8,13H,1,3,9H2,2H3
InChIKeyLMPQABUNNJGAQF-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.82
Rot. Bonds4

About 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine

2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine (PubChem CID 134356693) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine
PubChem CID134356693
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine
SMILESC=C(C)NCC(=C)c1ccccc1
InChIInChI=1S/C12H15N/c1-10(2)13-9-11(3)12-7-5-4-6-8-12/h4-8,13H,1,3,9H2,2H3
InChIKeyLMPQABUNNJGAQF-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-(2-phenylprop-2-enyl)prop-2-en-1-amine
CID 114616833
N-(2-phenylprop-2-enyl)butan-2-amine
CID 81332865
1-N,4-N-bis(2-phenylprop-2-enyl)bicyclo[2.2.2]octane-1,4-dicarboxamide
CID 166207880
2-methyl-N-(2-phenylprop-2-enyl)butan-2-amine
CID 90317419
3-methyl-N-(2-phenylprop-2-enyl)butan-1-amine
CID 90318133
N-(2-phenylprop-2-enyl)cyclopropanamine
CID 18333838
3-ethyl-N-(2-phenylprop-2-enyl)pentan-2-amine
CID 113288163
N-(4-phenylpent-4-enyl)acetamide
CID 10798197
2-ethyl-2-(2-phenylprop-2-enylamino)butan-1-ol
CID 113288152
pent-1-en-2-ylbenzene
CID 521761
3-phenylbut-3-enoic acid
CID 10702134
N-(cyclopropylmethyl)-2-phenylprop-2-en-1-amine
CID 78921499

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine?
The IUPAC name of 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine (CID 134356693) is 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine.
What is the SMILES notation for 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine?
The canonical SMILES for 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine is C=C(C)NCC(=C)c1ccccc1.
What is the InChIKey of 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine?
The InChIKey is LMPQABUNNJGAQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-10(2)13-9-11(3)12-7-5-4-6-8-12/h4-8,13H,1,3,9H2,2H3.
What are the key properties of 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine?
2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine has a molecular weight of 173.26 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-prop-1-en-2-ylprop-2-en-1-amine is sourced from PubChem (CID 134356693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).