N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide

C19H25N3O2 — CID 8593147

IUPACN-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
SMILESCC(C)CCNC(=O)NC(=O)CN(C)c1ccc2ccccc2c1
InChIInChI=1S/C19H25N3O2/c1-14(2)10-11-20-19(24)21-18(23)13-22(3)17-9-8-15-6-4-5-7-16(15)12-17/h4-9,12,14H,10-11,13H2,1-3H3,(H2,20,21,23,24)
InChIKeyJGKFPQDWXYIRHM-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.15
Rot. Bonds6

About N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide

N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide (PubChem CID 8593147) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
PubChem CID8593147
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
SMILESCC(C)CCNC(=O)NC(=O)CN(C)c1ccc2ccccc2c1
InChIInChI=1S/C19H25N3O2/c1-14(2)10-11-20-19(24)21-18(23)13-22(3)17-9-8-15-6-4-5-7-16(15)12-17/h4-9,12,14H,10-11,13H2,1-3H3,(H2,20,21,23,24)
InChIKeyJGKFPQDWXYIRHM-UHFFFAOYSA-N
XLogP3.15
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[methyl(naphthalen-2-yl)amino]-N-(2-methylpropylcarbamoyl)acetamide
CID 8593155
N-(2-acetamidoethyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 25337456
2-[[2-[methyl-(6-methylnaphthalen-2-yl)amino]acetyl]amino]ethyl-triphenylphosphanium
CID 118011322
N,N-dimethyl-4-[[2-[methyl(naphthalen-2-yl)amino]acetyl]amino]benzamide
CID 8593205
N-(2-acetylphenyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 8593322
[2-(3-methylbutylcarbamoylamino)-2-oxoethyl] benzoate
CID 2516996
2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-methylbutylcarbamoyl)acetamide
CID 8864731
2-[(4-bromophenyl)methyl-methylamino]-N-(3-methylbutylcarbamoyl)acetamide
CID 9039845
N-(3-methylbutyl)-2-(naphthalen-2-ylamino)propanamide
CID 43420253
N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 8593211
N-(2,5-difluorophenyl)-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 8593308
2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-(propylcarbamoyl)acetamide
CID 60588161

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide?
The IUPAC name of N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide (CID 8593147) is N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide.
What is the SMILES notation for N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide?
The canonical SMILES for N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide is CC(C)CCNC(=O)NC(=O)CN(C)c1ccc2ccccc2c1.
What is the InChIKey of N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide?
The InChIKey is JGKFPQDWXYIRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14(2)10-11-20-19(24)21-18(23)13-22(3)17-9-8-15-6-4-5-7-16(15)12-17/h4-9,12,14H,10-11,13H2,1-3H3,(H2,20,21,23,24).
What are the key properties of N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide?
N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide has a molecular weight of 327.43 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutylcarbamoyl)-2-[methyl(naphthalen-2-yl)amino]acetamide is sourced from PubChem (CID 8593147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).