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

C11H21N — CID 130650835

IUPAC2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine
SMILESCC1CC(NCC2(C)CC2)C1C
InChIInChI=1S/C11H21N/c1-8-6-10(9(8)2)12-7-11(3)4-5-11/h8-10,12H,4-7H2,1-3H3
InChIKeyZFGGMKQHJRFDQH-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.42
Rot. Bonds3

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

2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine (PubChem CID 130650835) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine
PubChem CID130650835
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine
SMILESCC1CC(NCC2(C)CC2)C1C
InChIInChI=1S/C11H21N/c1-8-6-10(9(8)2)12-7-11(3)4-5-11/h8-10,12H,4-7H2,1-3H3
InChIKeyZFGGMKQHJRFDQH-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.42
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-methylcyclopropyl)methyl]cyclobutan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine (CID 130650835) is 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine is CC1CC(NCC2(C)CC2)C1C.
What is the InChIKey of 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine?
The InChIKey is ZFGGMKQHJRFDQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-8-6-10(9(8)2)12-7-11(3)4-5-11/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine?
2,3-dimethyl-N-[(1-methylcyclopropyl)methyl]cyclobutan-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.42, 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-methylcyclopropyl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 130650835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).