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

C16H26N2O2 — CID 60854414

IUPAC2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide
SMILESCCCCC(N)C(=O)NC(C)c1ccc(OCC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-6-7-15(17)16(19)18-12(3)13-8-10-14(11-9-13)20-5-2/h8-12,15H,4-7,17H2,1-3H3,(H,18,19)
InChIKeyCUJVHLOZQVIQDO-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.78
Rot. Bonds8

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

2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide (PubChem CID 60854414) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide.

Molecular Properties

Compound Name2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide
PubChem CID60854414
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide
SMILESCCCCC(N)C(=O)NC(C)c1ccc(OCC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-6-7-15(17)16(19)18-12(3)13-8-10-14(11-9-13)20-5-2/h8-12,15H,4-7,17H2,1-3H3,(H,18,19)
InChIKeyCUJVHLOZQVIQDO-UHFFFAOYSA-N
XLogP2.78
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(4-ethoxyphenyl)ethyl]-5-methoxypentanamide
CID 81070435
2-amino-N-[1-(4-ethoxyphenyl)ethyl]butanamide
CID 43713696
2-amino-N-[1-(4-ethylphenyl)ethyl]hexanamide
CID 54928586
2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]pentanamide
CID 119311275
2-amino-N-[(1S)-1-pyridin-4-ylethyl]hexanamide
CID 81409725
(2S)-2-amino-N-[1-(4-ethoxyphenyl)ethyl]-3-methylpentanamide
CID 61174084
(2S)-2-amino-N-[1-(4-methylsulfonylphenyl)ethyl]hexanamide
CID 103831127
(2S)-2-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 107568369
2-amino-5-methoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]pentanamide
CID 81363764
2-amino-N-[1-(4-propan-2-ylphenyl)ethyl]pentanamide;hydrochloride
CID 119269406
(2R)-2-amino-N-[1-(4-methylphenyl)ethyl]pentanamide
CID 103794630
(2S)-2-amino-N-[1-(4-methoxyphenyl)ethyl]butanamide
CID 66196419

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide?
The IUPAC name of 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide (CID 60854414) is 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide.
What is the SMILES notation for 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide?
The canonical SMILES for 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide is CCCCC(N)C(=O)NC(C)c1ccc(OCC)cc1.
What is the InChIKey of 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide?
The InChIKey is CUJVHLOZQVIQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-6-7-15(17)16(19)18-12(3)13-8-10-14(11-9-13)20-5-2/h8-12,15H,4-7,17H2,1-3H3,(H,18,19).
What are the key properties of 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide?
2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide has a molecular weight of 278.40 g/mol, XLogP of 2.78, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(4-ethoxyphenyl)ethyl]hexanamide is sourced from PubChem (CID 60854414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).