N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine

C12H25N — CID 123374526

IUPACN,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine
SMILESCC(C)CC1C(C)CC1CN(C)C
InChIInChI=1S/C12H25N/c1-9(2)6-12-10(3)7-11(12)8-13(4)5/h9-12H,6-8H2,1-5H3
InChIKeyMJSQKQMDCJEAJK-UHFFFAOYSA-N
MW183.34 g/mol
LogP2.87
Rot. Bonds4

About N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine

N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine (PubChem CID 123374526) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine
PubChem CID123374526
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine
SMILESCC(C)CC1C(C)CC1CN(C)C
InChIInChI=1S/C12H25N/c1-9(2)6-12-10(3)7-11(12)8-13(4)5/h9-12H,6-8H2,1-5H3
InChIKeyMJSQKQMDCJEAJK-UHFFFAOYSA-N
XLogP2.87
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-3-methyl-2-(2-methylpropyl)cyclobutane
CID 158664832
methane;bis([3-methyl-2-(2-methylpropyl)cyclobutyl]methanol)
CID 161111254
N,N-dimethyl-1-[(1R,2R)-2-methylcyclopropyl]methanamine
CID 129256150
N,N-dimethyl-1-[(2S)-2-methylcyclopropyl]methanamine
CID 153082605
3-[[hydroxy(methyl)amino]methyl]-2-(2-methylpropyl)cyclobutan-1-ol
CID 146572732
1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1-ethyl-3-methyl-2-(2-methylbutyl)cyclobutane
CID 90801138
2-(2-methylpropyl)bicyclo[1.1.0]butane
CID 123355318
1,3-dimethyl-2-(2-methylpropyl)cyclohexane
CID 91143805
N,N-dimethyl-1-[(1S,2R)-2-methylcyclopentyl]methanamine
CID 167145219
1-ethyl-2-[2-(2-ethyl-3-methylcyclobutyl)propyl]-3-methylcyclobutane
CID 90753292
1-[(1R,2R)-2-[(dimethylamino)methyl]cyclohexyl]-N,N-dimethylmethanamine
CID 22812116

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine (CID 123374526) is N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine is CC(C)CC1C(C)CC1CN(C)C.
What is the InChIKey of N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine?
The InChIKey is MJSQKQMDCJEAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-9(2)6-12-10(3)7-11(12)8-13(4)5/h9-12H,6-8H2,1-5H3.
What are the key properties of N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine?
N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine has a molecular weight of 183.34 g/mol, XLogP of 2.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine is sourced from PubChem (CID 123374526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).