N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine

C15H25N — CID 79299268

IUPACN-ethyl-2,4-dimethyl-1-phenylpentan-3-amine
SMILESCCNC(C(C)C)C(C)Cc1ccccc1
InChIInChI=1S/C15H25N/c1-5-16-15(12(2)3)13(4)11-14-9-7-6-8-10-14/h6-10,12-13,15-16H,5,11H2,1-4H3
InChIKeySCMDHKXQRASXPM-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.50
Rot. Bonds6

About N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine

N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine (PubChem CID 79299268) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine.

Molecular Properties

Compound NameN-ethyl-2,4-dimethyl-1-phenylpentan-3-amine
PubChem CID79299268
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-ethyl-2,4-dimethyl-1-phenylpentan-3-amine
SMILESCCNC(C(C)C)C(C)Cc1ccccc1
InChIInChI=1S/C15H25N/c1-5-16-15(12(2)3)13(4)11-14-9-7-6-8-10-14/h6-10,12-13,15-16H,5,11H2,1-4H3
InChIKeySCMDHKXQRASXPM-UHFFFAOYSA-N
XLogP3.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dimethylbutylbenzene
CID 12054035
N,2,3-trimethyl-4-phenylbutan-1-amine
CID 81016315
2-benzyl-N,4-dimethyl-1-phenylpentan-3-amine
CID 79304006
N-ethyl-3-methyl-1,1-diphenylbutan-2-amine
CID 60817823
2,4-dimethyl-6-phenyl-N-propylhexan-3-amine
CID 79298844
1-(4-fluorophenyl)-2,4-dimethyl-N-propylpentan-3-amine
CID 114834921
acetic acid;N-ethyl-1-phenylpropan-2-amine
CID 22214099
(2S,3S)-3-methyl-4-phenylbutan-2-ol
CID 11194521
(3-bromo-2,4-dimethylpentyl)benzene
CID 79298231
2-(ethylamino)-3-phenylpropanal
CID 3325220
2-methyl-1-phenyl-N-propylpentan-3-amine
CID 63561010
(2-benzyl-3-methylbutyl)benzene
CID 22277918

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine?
The IUPAC name of N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine (CID 79299268) is N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine.
What is the SMILES notation for N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine?
The canonical SMILES for N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine is CCNC(C(C)C)C(C)Cc1ccccc1.
What is the InChIKey of N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine?
The InChIKey is SCMDHKXQRASXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-5-16-15(12(2)3)13(4)11-14-9-7-6-8-10-14/h6-10,12-13,15-16H,5,11H2,1-4H3.
What are the key properties of N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine?
N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine has a molecular weight of 219.37 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethyl-1-phenylpentan-3-amine is sourced from PubChem (CID 79299268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).