N-benzyl-2-methoxy-N-propan-2-ylpropanamide

C14H21NO2 — CID 115588172

IUPACN-benzyl-2-methoxy-N-propan-2-ylpropanamide
SMILESCOC(C)C(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C14H21NO2/c1-11(2)15(14(16)12(3)17-4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3
InChIKeyHCPRPBZUPKDUQJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.46
Rot. Bonds5

About N-benzyl-2-methoxy-N-propan-2-ylpropanamide

N-benzyl-2-methoxy-N-propan-2-ylpropanamide (PubChem CID 115588172) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-benzyl-2-methoxy-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-benzyl-2-methoxy-N-propan-2-ylpropanamide
PubChem CID115588172
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-benzyl-2-methoxy-N-propan-2-ylpropanamide
SMILESCOC(C)C(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C14H21NO2/c1-11(2)15(14(16)12(3)17-4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3
InChIKeyHCPRPBZUPKDUQJ-UHFFFAOYSA-N
XLogP2.46
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-methoxy-N-methylpropanamide
CID 112685507
N-benzyl-N-propan-2-ylacetamide
CID 23534449
(2S)-2-amino-N-benzyl-3-methyl-N-propan-2-ylbutanamide
CID 22690747
2-acetamido-N-benzyl-N-propan-2-yl-3-sulfanylpropanamide
CID 107768981
2-amino-N-benzyl-4-methoxy-N-propan-2-ylbutanamide
CID 62474789
2-methoxy-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 112686946
1-benzyl-3-ethyl-1-propan-2-ylurea
CID 108890429
methyl 2-[2-aminopropanoyl(benzyl)amino]propanoate
CID 76625736
methyl (2S)-2-[acetyl(benzyl)amino]propanoate
CID 75437880
1-benzyl-3-phenyl-1-propan-2-ylurea;ethane
CID 160933231
N,N'-dibenzyl-N-methyl-N'-propan-2-ylpropanediamide
CID 108946081
5-amino-N-benzyl-2-methyl-N-propan-2-ylpentanamide
CID 104683482

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methoxy-N-propan-2-ylpropanamide?
The IUPAC name of N-benzyl-2-methoxy-N-propan-2-ylpropanamide (CID 115588172) is N-benzyl-2-methoxy-N-propan-2-ylpropanamide.
What is the SMILES notation for N-benzyl-2-methoxy-N-propan-2-ylpropanamide?
The canonical SMILES for N-benzyl-2-methoxy-N-propan-2-ylpropanamide is COC(C)C(=O)N(Cc1ccccc1)C(C)C.
What is the InChIKey of N-benzyl-2-methoxy-N-propan-2-ylpropanamide?
The InChIKey is HCPRPBZUPKDUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-11(2)15(14(16)12(3)17-4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3.
What are the key properties of N-benzyl-2-methoxy-N-propan-2-ylpropanamide?
N-benzyl-2-methoxy-N-propan-2-ylpropanamide has a molecular weight of 235.33 g/mol, XLogP of 2.46, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methoxy-N-propan-2-ylpropanamide is sourced from PubChem (CID 115588172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).