N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide

C15H22N2O2 — CID 103555368

IUPACN-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)Nc2c(C)ccc(N)c2C)CCC1
InChIInChI=1S/C15H22N2O2/c1-10-5-6-12(16)11(2)14(10)17-13(18)9-15(19-3)7-4-8-15/h5-6H,4,7-9,16H2,1-3H3,(H,17,18)
InChIKeyFTKZDTVAVSQJJD-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.78
Rot. Bonds4

About N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide

N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide (PubChem CID 103555368) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide
PubChem CID103555368
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)Nc2c(C)ccc(N)c2C)CCC1
InChIInChI=1S/C15H22N2O2/c1-10-5-6-12(16)11(2)14(10)17-13(18)9-15(19-3)7-4-8-15/h5-6H,4,7-9,16H2,1-3H3,(H,17,18)
InChIKeyFTKZDTVAVSQJJD-UHFFFAOYSA-N
XLogP2.78
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-4-methyl-2-pyridinyl)-2-(1-methoxycyclobutyl)acetamide
CID 103555420
N-(4-amino-5-chloro-2-methylphenyl)-2-(1-methoxycyclobutyl)acetamide
CID 103555460
1-(4-amino-3-methylphenyl)-2-(1-methoxycyclobutyl)ethanone
CID 103558404
N-(3-amino-2,6-dimethylphenyl)butanamide
CID 24711453
methyl N-(3-amino-2,6-dimethylphenyl)carbamate
CID 19857501
3-[[2-(1-methoxycyclobutyl)acetyl]amino]-4-methylbenzoic acid
CID 103555485
N-(3-amino-2,6-dimethylphenyl)-2-ethoxyacetamide
CID 28776914
5-[[2-(1-methoxycyclobutyl)acetyl]amino]-2,3-dimethylbenzoic acid
CID 103555614
4-[[2-(1-methoxycyclobutyl)acetyl]amino]-3-methylbenzoic acid
CID 103555498
(3-amino-2,6-dimethylphenyl)urea
CID 19820899
2-(1-methoxycyclobutyl)acetohydrazide
CID 103555801
N-(3-amino-2,6-dimethylphenyl)decanamide
CID 65448531

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide?
The IUPAC name of N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide (CID 103555368) is N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide.
What is the SMILES notation for N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide?
The canonical SMILES for N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide is COC1(CC(=O)Nc2c(C)ccc(N)c2C)CCC1.
What is the InChIKey of N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide?
The InChIKey is FTKZDTVAVSQJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-5-6-12(16)11(2)14(10)17-13(18)9-15(19-3)7-4-8-15/h5-6H,4,7-9,16H2,1-3H3,(H,17,18).
What are the key properties of N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide?
N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide is sourced from PubChem (CID 103555368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).