N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide

C15H23N3O3 — CID 60853865

IUPACN-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
SMILESCCCCC(N)C(=O)Nc1cc(NC(C)=O)ccc1OC
InChIInChI=1S/C15H23N3O3/c1-4-5-6-12(16)15(20)18-13-9-11(17-10(2)19)7-8-14(13)21-3/h7-9,12H,4-6,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyJGBJTPHCCKPKST-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.11
Rot. Bonds7

About N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide

N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide (PubChem CID 60853865) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
PubChem CID60853865
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
SMILESCCCCC(N)C(=O)Nc1cc(NC(C)=O)ccc1OC
InChIInChI=1S/C15H23N3O3/c1-4-5-6-12(16)15(20)18-13-9-11(17-10(2)19)7-8-14(13)21-3/h7-9,12H,4-6,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyJGBJTPHCCKPKST-UHFFFAOYSA-N
XLogP2.11
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(2S)-2-aminohexanoyl]amino]-4-methoxybenzamide
CID 103831255
3-[[(2S)-2-aminohexanoyl]amino]-4-methoxybenzoic acid
CID 107145552
2-amino-N-(5-tert-butyl-2-methoxyphenyl)hexanamide
CID 60852777
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368
2-amino-N-(4-bromo-3-methoxyphenyl)hexanamide
CID 115443247
N-(3-acetamidophenyl)-2-aminohexanamide
CID 60852572
2-amino-N-(4-chloro-2,5-dimethoxyphenyl)hexanamide
CID 60853463
N-(5-acetamido-2-methoxyphenyl)-3-amino-2-methylpropanamide
CID 62671021
(2S)-N-(4-acetamido-2-methoxyphenyl)-2-methylhexanamide
CID 100726850
(2S)-2-amino-N-(3,4-diethoxyphenyl)hexanamide
CID 103830950
2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
CID 119263329
2-[5-(2,5-diaminopentanoylamino)-2-methoxyanilino]acetic acid
CID 123852911

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide (CID 60853865) is N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide is CCCCC(N)C(=O)Nc1cc(NC(C)=O)ccc1OC.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide?
The InChIKey is JGBJTPHCCKPKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-4-5-6-12(16)15(20)18-13-9-11(17-10(2)19)7-8-14(13)21-3/h7-9,12H,4-6,16H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide?
N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide has a molecular weight of 293.37 g/mol, XLogP of 2.11, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide is sourced from PubChem (CID 60853865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).