2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide

C16H26N2O — CID 54928586

IUPAC2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide
SMILESCCCCC(N)C(=O)NC(C)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2O/c1-4-6-7-15(17)16(19)18-12(3)14-10-8-13(5-2)9-11-14/h8-12,15H,4-7,17H2,1-3H3,(H,18,19)
InChIKeyYQPGRIMQHYRREE-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.94
Rot. Bonds7

About 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide

2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide (PubChem CID 54928586) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide.

Molecular Properties

Compound Name2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide
PubChem CID54928586
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide
SMILESCCCCC(N)C(=O)NC(C)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2O/c1-4-6-7-15(17)16(19)18-12(3)14-10-8-13(5-2)9-11-14/h8-12,15H,4-7,17H2,1-3H3,(H,18,19)
InChIKeyYQPGRIMQHYRREE-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(1S)-1-pyridin-4-ylethyl]hexanamide
CID 81409725
3-amino-4-[1-(4-ethylphenyl)ethylamino]-4-oxobutanoic acid
CID 64896081
(2S)-2-amino-N-[1-(4-methylsulfonylphenyl)ethyl]hexanamide
CID 103831127
2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide
CID 60854414
(2S)-2-amino-N-[1-(4-ethylphenyl)ethyl]-4-methylsulfanylbutanamide;hydrochloride
CID 119269302
(2R)-2-amino-N-[1-[4-(2-methylpropyl)phenyl]ethyl]pentanamide
CID 103793979
2-amino-N-[1-(4-ethylphenyl)ethyl]-3-methoxypropanamide
CID 81083669
2-amino-N-[1-(4-propan-2-ylphenyl)ethyl]pentanamide;hydrochloride
CID 119269406
(2R)-2-amino-N-[1-(4-methylphenyl)ethyl]pentanamide
CID 103794630
2-amino-N-[1-(4-ethylphenyl)ethyl]-3,3-dimethylbutanamide
CID 76887263
(2R)-2-amino-N-[1-(4-ethylphenyl)ethyl]-3,3-dimethylbutanamide
CID 103928673
(2R)-2-amino-N-[(1S)-1-pyridin-3-ylethyl]hexanamide
CID 93339984

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide?
The IUPAC name of 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide (CID 54928586) is 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide.
What is the SMILES notation for 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide?
The canonical SMILES for 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide is CCCCC(N)C(=O)NC(C)c1ccc(CC)cc1.
What is the InChIKey of 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide?
The InChIKey is YQPGRIMQHYRREE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-6-7-15(17)16(19)18-12(3)14-10-8-13(5-2)9-11-14/h8-12,15H,4-7,17H2,1-3H3,(H,18,19).
What are the key properties of 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide?
2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide has a molecular weight of 262.40 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide is sourced from PubChem (CID 54928586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).