N-ethyl-N-methyl-2-phenylpent-4-en-2-amine

C14H21N — CID 174778712

IUPACN-ethyl-N-methyl-2-phenylpent-4-en-2-amine
SMILESC=CCC(C)(c1ccccc1)N(C)CC
InChIInChI=1S/C14H21N/c1-5-12-14(3,15(4)6-2)13-10-8-7-9-11-13/h5,7-11H,1,6,12H2,2-4H3
InChIKeyRVJCBPPERZGNLM-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.43
Rot. Bonds5

About N-ethyl-N-methyl-2-phenylpent-4-en-2-amine

N-ethyl-N-methyl-2-phenylpent-4-en-2-amine (PubChem CID 174778712) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-phenylpent-4-en-2-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-phenylpent-4-en-2-amine
PubChem CID174778712
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-ethyl-N-methyl-2-phenylpent-4-en-2-amine
SMILESC=CCC(C)(c1ccccc1)N(C)CC
InChIInChI=1S/C14H21N/c1-5-12-14(3,15(4)6-2)13-10-8-7-9-11-13/h5,7-11H,1,6,12H2,2-4H3
InChIKeyRVJCBPPERZGNLM-UHFFFAOYSA-N
XLogP3.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(benzenesulfonyl)pent-4-en-2-ylbenzene
CID 25111406
dilithium;1-phenylbut-3-ene-1,1-diolate
CID 134892935
(2S)-2-methyl-2-phenylpent-4-enal
CID 10866831
4-propylhept-1-en-4-ylbenzene
CID 123221616
[(2R)-2-prop-2-enoxypent-4-en-2-yl]benzene
CID 100966368
[(2S)-2-prop-2-enoxypent-4-en-2-yl]benzene
CID 100966369
4-(1,1-diphenylbut-3-enyl)-1,2-dimethylbenzene
CID 71583153
2-[methyl(prop-2-enyl)amino]-2-phenylpropanoic acid
CID 70010051
1-phenylbut-3-ene-1,1-diol
CID 134892936
1-[dimethyl(phenyl)silyl]-N,N-dimethyl-1-phenylbut-3-en-1-amine
CID 101362394
(1-methoxy-1-phenylbut-3-enyl)benzene;hydrate
CID 67237772
4-phenylhepta-1,6-diene-4-sulfonamide
CID 174876491

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-phenylpent-4-en-2-amine?
The IUPAC name of N-ethyl-N-methyl-2-phenylpent-4-en-2-amine (CID 174778712) is N-ethyl-N-methyl-2-phenylpent-4-en-2-amine.
What is the SMILES notation for N-ethyl-N-methyl-2-phenylpent-4-en-2-amine?
The canonical SMILES for N-ethyl-N-methyl-2-phenylpent-4-en-2-amine is C=CCC(C)(c1ccccc1)N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-2-phenylpent-4-en-2-amine?
The InChIKey is RVJCBPPERZGNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-5-12-14(3,15(4)6-2)13-10-8-7-9-11-13/h5,7-11H,1,6,12H2,2-4H3.
What are the key properties of N-ethyl-N-methyl-2-phenylpent-4-en-2-amine?
N-ethyl-N-methyl-2-phenylpent-4-en-2-amine has a molecular weight of 203.33 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-phenylpent-4-en-2-amine is sourced from PubChem (CID 174778712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).