1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone

C8H15NO — CID 146800799

IUPAC1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone
SMILESCNC1(C(C)=O)CC[C@@H]1C
InChIInChI=1S/C8H15NO/c1-6-4-5-8(6,9-3)7(2)10/h6,9H,4-5H2,1-3H3/t6-,8?/m0/s1
InChIKeyRXVVVHAKSYDMSN-UUEFVBAFSA-N
MW141.21 g/mol
LogP0.96
Rot. Bonds2

About 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone

1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone (PubChem CID 146800799) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone.

Molecular Properties

Compound Name1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone
PubChem CID146800799
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone
SMILESCNC1(C(C)=O)CC[C@@H]1C
InChIInChI=1S/C8H15NO/c1-6-4-5-8(6,9-3)7(2)10/h6,9H,4-5H2,1-3H3/t6-,8?/m0/s1
InChIKeyRXVVVHAKSYDMSN-UUEFVBAFSA-N
XLogP0.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-1-(methylamino)cyclohexane-1-carboxamide
CID 64754739
2-methyl-1-(methylamino)cyclopropane-1-carboxylic acid
CID 4627778
1-(1-ethyl-2-methylcyclobutyl)ethanone
CID 59190029
N-[(2R)-1-acetyl-2-methylcyclopropyl]acetamide
CID 143744019
ethyl 2-methyl-1-(methylamino)cyclopentane-1-carboxylate
CID 65045182
1-[(1R,2S)-2-ethenyl-1-(methylamino)cyclopropyl]ethanone
CID 59493438
dimethyl 2-methylcyclobutane-1,1-dicarboxylate
CID 574749
methyl 2,4,4-trimethyl-1-(methylamino)cyclohexane-1-carboxylate
CID 81320916
1-[(1S,3R)-1-hydroxy-2,2,3-trimethylcyclopentyl]ethanone
CID 134856008
1-[1-(methylamino)cycloheptyl]ethanone
CID 59493685
2,3-dimethyl-1-(methylamino)cyclohexane-1-carboxamide
CID 64754738
1-acetamido-2-methylcyclohexane-1-carboxylic acid
CID 61292640

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone?
The IUPAC name of 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone (CID 146800799) is 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone.
What is the SMILES notation for 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone?
The canonical SMILES for 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone is CNC1(C(C)=O)CC[C@@H]1C.
What is the InChIKey of 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone?
The InChIKey is RXVVVHAKSYDMSN-UUEFVBAFSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-4-5-8(6,9-3)7(2)10/h6,9H,4-5H2,1-3H3/t6-,8?/m0/s1.
What are the key properties of 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone?
1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone has a molecular weight of 141.21 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-methyl-1-(methylamino)cyclobutyl]ethanone is sourced from PubChem (CID 146800799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).