5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide

C16H26N2O — CID 104683482

IUPAC5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide
SMILESCC(CCCN)C(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C16H26N2O/c1-13(2)18(12-15-9-5-4-6-10-15)16(19)14(3)8-7-11-17/h4-6,9-10,13-14H,7-8,11-12,17H2,1-3H3
InChIKeyWGYSMOAUCWKXFA-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.80
Rot. Bonds7

About 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide

5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide (PubChem CID 104683482) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide
PubChem CID104683482
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide
SMILESCC(CCCN)C(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C16H26N2O/c1-13(2)18(12-15-9-5-4-6-10-15)16(19)14(3)8-7-11-17/h4-6,9-10,13-14H,7-8,11-12,17H2,1-3H3
InChIKeyWGYSMOAUCWKXFA-UHFFFAOYSA-N
XLogP2.80
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 ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-benzyl-3-methyl-N-propan-2-ylbutanamide
CID 22690747
N-(2-aminoethyl)-N'-benzyl-N'-propan-2-yloxamide
CID 43316028
N-benzyl-N-propan-2-ylacetamide
CID 23534449
N-benzyl-2-methoxy-N-propan-2-ylpropanamide
CID 115588172
2-amino-N-benzyl-4-methoxy-N-propan-2-ylbutanamide
CID 62474789
2-acetamido-N-benzyl-N-propan-2-yl-3-sulfanylpropanamide
CID 107768981
(2R)-N,N-dibenzyl-5-hydroxy-2-methylpentanamide
CID 155444836
N-benzyl-4-methyl-N-propan-2-ylpentanamide
CID 86978961
5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide
CID 104683623
N-(3-aminopropyl)-N-benzyl-2,3-dimethylbutanamide
CID 107365679
4-[[benzyl(propan-2-yl)carbamoyl]amino]-2-methylbutanoic acid
CID 80537936
5-amino-2-methyl-N-phenylmethoxypentanamide
CID 104685201

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide?
The IUPAC name of 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide (CID 104683482) is 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide.
What is the SMILES notation for 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide?
The canonical SMILES for 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide is CC(CCCN)C(=O)N(Cc1ccccc1)C(C)C.
What is the InChIKey of 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide?
The InChIKey is WGYSMOAUCWKXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(2)18(12-15-9-5-4-6-10-15)16(19)14(3)8-7-11-17/h4-6,9-10,13-14H,7-8,11-12,17H2,1-3H3.
What are the key properties of 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide?
5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide has a molecular weight of 262.40 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide is sourced from PubChem (CID 104683482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).