N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide

C16H24N2O — CID 103561080

IUPACN-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC2CC(C(C)C)C2)cc1C
InChIInChI=1S/C16H24N2O/c1-10(2)13-8-15(9-13)18-14-5-6-16(11(3)7-14)17-12(4)19/h5-7,10,13,15,18H,8-9H2,1-4H3,(H,17,19)
InChIKeyJWFADYIUZPIBED-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.80
Rot. Bonds4

About N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide

N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide (PubChem CID 103561080) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide
PubChem CID103561080
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC2CC(C(C)C)C2)cc1C
InChIInChI=1S/C16H24N2O/c1-10(2)13-8-15(9-13)18-14-5-6-16(11(3)7-14)17-12(4)19/h5-7,10,13,15,18H,8-9H2,1-4H3,(H,17,19)
InChIKeyJWFADYIUZPIBED-UHFFFAOYSA-N
XLogP3.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methyl-4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]phenyl]acetamide
CID 43672871
N-[2-methyl-4-[(4-methylcyclohexyl)amino]phenyl]acetamide
CID 43672817
N-[4-[(4-ethylcycloheptyl)amino]-2-methylphenyl]acetamide
CID 65084031
methyl 3-methyl-4-[(3-propan-2-ylcyclobutyl)amino]benzoate
CID 103561438
N,3-dimethyl-4-[(3-propan-2-ylcyclobutyl)amino]benzamide
CID 103561516
N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide
CID 43672835
N-[4-(butan-2-ylamino)-2-methylphenyl]acetamide
CID 43672867
N-[2-methyl-4-(pentan-3-ylamino)phenyl]acetamide
CID 43672883
N-[2-fluoro-5-[(3-methylcyclobutyl)amino]phenyl]acetamide
CID 104860140
N-[2-methyl-4-[[(3R)-2-oxoazepan-3-yl]amino]phenyl]acetamide
CID 25344003
(1R,2S,3R,4R)-3-[(4-acetamido-3-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 98219368
N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide
CID 46421778

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide?
The IUPAC name of N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide (CID 103561080) is N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide.
What is the SMILES notation for N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide?
The canonical SMILES for N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide is CC(=O)Nc1ccc(NC2CC(C(C)C)C2)cc1C.
What is the InChIKey of N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide?
The InChIKey is JWFADYIUZPIBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-10(2)13-8-15(9-13)18-14-5-6-16(11(3)7-14)17-12(4)19/h5-7,10,13,15,18H,8-9H2,1-4H3,(H,17,19).
What are the key properties of N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide?
N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide has a molecular weight of 260.38 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-[(3-propan-2-ylcyclobutyl)amino]phenyl]acetamide is sourced from PubChem (CID 103561080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).