2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide

C16H26N2O — CID 54870822

IUPAC2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide
SMILESCCCCN(C(=O)C(N)c1ccccc1)C(C)CC
InChIInChI=1S/C16H26N2O/c1-4-6-12-18(13(3)5-2)16(19)15(17)14-10-8-7-9-11-14/h7-11,13,15H,4-6,12,17H2,1-3H3
InChIKeyMBYOOEUEVMOLAK-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.11
Rot. Bonds7

About 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide

2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide (PubChem CID 54870822) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide
PubChem CID54870822
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide
SMILESCCCCN(C(=O)C(N)c1ccccc1)C(C)CC
InChIInChI=1S/C16H26N2O/c1-4-6-12-18(13(3)5-2)16(19)15(17)14-10-8-7-9-11-14/h7-11,13,15H,4-6,12,17H2,1-3H3
InChIKeyMBYOOEUEVMOLAK-UHFFFAOYSA-N
XLogP3.11
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-ethyl-2-phenyl-N-propan-2-ylacetamide
CID 61156565
2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide
CID 54870866
2-amino-N-(2-amino-2-oxoethyl)-N-butyl-2-phenylacetamide
CID 60946442
2-amino-N-butyl-N-(1-phenylethyl)pentanamide
CID 119331563
(2R)-2-amino-N-butyl-2-phenyl-N-(2,2,2-trifluoroethyl)acetamide
CID 61164511
(2R)-2-amino-N-butan-2-yl-N-butyl-3-methylbutanamide
CID 79012967
2-amino-N-butan-2-yl-N-ethyl-2-(4-methylphenyl)acetamide
CID 106312072
(2S)-2-amino-N-butan-2-yl-N-butylpentanamide
CID 107568931
N-butan-2-yl-N-butyl-2-(2-fluorophenyl)acetamide
CID 78805640
4-amino-N-butyl-N-(1-phenylpropyl)butanamide
CID 119323712
ethyl (2R)-2-amino-2-phenylacetate
CID 6922658
(2S)-2-amino-N-methyl-N-pentan-3-yl-2-phenylacetamide
CID 93248514

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide?
The IUPAC name of 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide (CID 54870822) is 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide?
The canonical SMILES for 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide is CCCCN(C(=O)C(N)c1ccccc1)C(C)CC.
What is the InChIKey of 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide?
The InChIKey is MBYOOEUEVMOLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-6-12-18(13(3)5-2)16(19)15(17)14-10-8-7-9-11-14/h7-11,13,15H,4-6,12,17H2,1-3H3.
What are the key properties of 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide?
2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide has a molecular weight of 262.40 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butan-2-yl-N-butyl-2-phenylacetamide is sourced from PubChem (CID 54870822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).