N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide

C15H24N2O2 — CID 82259972

IUPACN-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(CC(N)CC(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)8-13(16)9-12-4-6-14(7-5-12)17-15(18)10-19-3/h4-7,11,13H,8-10,16H2,1-3H3,(H,17,18)
InChIKeyNDDOWVBRDWWCMW-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.19
Rot. Bonds7

About N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide

N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide (PubChem CID 82259972) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide
PubChem CID82259972
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(CC(N)CC(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)8-13(16)9-12-4-6-14(7-5-12)17-15(18)10-19-3/h4-7,11,13H,8-10,16H2,1-3H3,(H,17,18)
InChIKeyNDDOWVBRDWWCMW-UHFFFAOYSA-N
XLogP2.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-amino-4-methylpentyl)phenyl]-2,2-dimethylpropanamide
CID 82259967
N-[4-(hydroxymethyl)phenyl]-2-methoxyacetamide
CID 64794296
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylbutanamide
CID 42948482
2-bromo-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide
CID 114014349
2-methoxy-N-[4-[1-(methylamino)ethyl]phenyl]acetamide
CID 61279184
(2S)-2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]pentanamide
CID 107568581
acetic acid;(2S,3S)-2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-3-methylpentanamide
CID 154915033
N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717389
methyl (2S,4R)-4-amino-2-methyl-5-[4-(phenylmethoxycarbonylamino)phenyl]pentanoate
CID 90338257
N-[4-(dicyclopropylmethylamino)phenyl]-2-methoxyacetamide
CID 43717450

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide?
The IUPAC name of N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide (CID 82259972) is N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide is COCC(=O)Nc1ccc(CC(N)CC(C)C)cc1.
What is the InChIKey of N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide?
The InChIKey is NDDOWVBRDWWCMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)8-13(16)9-12-4-6-14(7-5-12)17-15(18)10-19-3/h4-7,11,13H,8-10,16H2,1-3H3,(H,17,18).
What are the key properties of N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide?
N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide has a molecular weight of 264.37 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-4-methylpentyl)phenyl]-2-methoxyacetamide is sourced from PubChem (CID 82259972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).