2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine

C14H29N — CID 107897482

IUPAC2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine
SMILESCCCC(C)C1(CNC(C)(C)C)CCC1
InChIInChI=1S/C14H29N/c1-6-8-12(2)14(9-7-10-14)11-15-13(3,4)5/h12,15H,6-11H2,1-5H3
InChIKeyZEZSITVEFCZWBE-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.98
Rot. Bonds5

About 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine

2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine (PubChem CID 107897482) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine
PubChem CID107897482
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine
SMILESCCCC(C)C1(CNC(C)(C)C)CCC1
InChIInChI=1S/C14H29N/c1-6-8-12(2)14(9-7-10-14)11-15-13(3,4)5/h12,15H,6-11H2,1-5H3
InChIKeyZEZSITVEFCZWBE-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-Tert-butyl-1-azaspiro[3.3]heptane
CID 166000829
9-Methyl-6-azaspiro(3.5)nonane
CID 71757949
3-tert-butyl-N-cyclopropylcyclobutan-1-amine hydrochloride
CID 121553319
9-Azadispiro[3.0.3^{5}.2^{4}]decane
CID 146155799
3-Ethyl-1-azaspiro[3.3]heptane hydrochloride
CID 165691647
2,2-Ditert-butylazepane
CID 71287765
N-Ethyl-4-methyl-4-octanamine
CID 575205
N-Ethyl-5-propyl-5-nonanamine
CID 593700
Tetra-propyl-butyl-octyl ammonium bromide
CID 129693978
3-tert-butyl-N-cyclopropylcyclobutan-1-amine
CID 80360797
Methyl({spiro[3.5]nonan-5-yl}methyl)amine
CID 83905647
2-Cyclobutyl-4-fluoro-2-methylpyrrolidine
CID 115012284

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine (CID 107897482) is 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine is CCCC(C)C1(CNC(C)(C)C)CCC1.
What is the InChIKey of 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine?
The InChIKey is ZEZSITVEFCZWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-6-8-12(2)14(9-7-10-14)11-15-13(3,4)5/h12,15H,6-11H2,1-5H3.
What are the key properties of 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine?
2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-pentan-2-ylcyclobutyl)methyl]propan-2-amine is sourced from PubChem (CID 107897482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).