N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide

C15H24N2O2 — CID 54817835

IUPACN-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide
SMILESCCCCOc1ccccc1NC(=O)CNC(C)C
InChIInChI=1S/C15H24N2O2/c1-4-5-10-19-14-9-7-6-8-13(14)17-15(18)11-16-12(2)3/h6-9,12,16H,4-5,10-11H2,1-3H3,(H,17,18)
InChIKeyCMMFZOYTDLZBJC-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.80
Rot. Bonds8

About N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide

N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide (PubChem CID 54817835) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide
PubChem CID54817835
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide
SMILESCCCCOc1ccccc1NC(=O)CNC(C)C
InChIInChI=1S/C15H24N2O2/c1-4-5-10-19-14-9-7-6-8-13(14)17-15(18)11-16-12(2)3/h6-9,12,16H,4-5,10-11H2,1-3H3,(H,17,18)
InChIKeyCMMFZOYTDLZBJC-UHFFFAOYSA-N
XLogP2.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-phenoxyethoxy)phenyl]-2-(propan-2-ylamino)acetamide
CID 54817766
N-(2-butoxyphenyl)-3-methylbutanamide
CID 19204184
N-(2-butoxyphenyl)propanamide
CID 15943029
N-(2-butoxyphenyl)-2-(2-propan-2-ylanilino)acetamide
CID 54823404
N,N'-bis(2-butoxyphenyl)hexanediamide
CID 17087317
2-(propan-2-ylamino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54817694
4-(propan-2-ylamino)-N-(2-propoxyphenyl)butanamide
CID 60851317
1,3-bis(2-butoxyphenyl)urea
CID 17170447
N-(2-butoxyphenyl)tetradecanamide
CID 54789601
N-(2-butoxyphenyl)-2-[4-(2-methylpropoxy)anilino]acetamide
CID 54820437
N-(2-butoxyphenyl)-2-(4-heptoxyanilino)acetamide
CID 54822084
14-(2-butoxyanilino)-14-oxotetradecanoic acid
CID 57100527

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide?
The IUPAC name of N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide (CID 54817835) is N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide.
What is the SMILES notation for N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide?
The canonical SMILES for N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide is CCCCOc1ccccc1NC(=O)CNC(C)C.
What is the InChIKey of N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide?
The InChIKey is CMMFZOYTDLZBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-5-10-19-14-9-7-6-8-13(14)17-15(18)11-16-12(2)3/h6-9,12,16H,4-5,10-11H2,1-3H3,(H,17,18).
What are the key properties of N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide?
N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.80, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyphenyl)-2-(propan-2-ylamino)acetamide is sourced from PubChem (CID 54817835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).