2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine

C13H25N — CID 130618286

IUPAC2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine
SMILESCC1CC(NCC2(C)CCCC2)C1C
InChIInChI=1S/C13H25N/c1-10-8-12(11(10)2)14-9-13(3)6-4-5-7-13/h10-12,14H,4-9H2,1-3H3
InChIKeyTUSAIXZWHQVLOR-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds3

About 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine

2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine (PubChem CID 130618286) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine
PubChem CID130618286
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine
SMILESCC1CC(NCC2(C)CCCC2)C1C
InChIInChI=1S/C13H25N/c1-10-8-12(11(10)2)14-9-13(3)6-4-5-7-13/h10-12,14H,4-9H2,1-3H3
InChIKeyTUSAIXZWHQVLOR-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine (CID 130618286) is 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine is CC1CC(NCC2(C)CCCC2)C1C.
What is the InChIKey of 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine?
The InChIKey is TUSAIXZWHQVLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-10-8-12(11(10)2)14-9-13(3)6-4-5-7-13/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine?
2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(1-methylcyclopentyl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 130618286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).