3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine

C13H26N2 — CID 103560886

IUPAC3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine
SMILESCC(C)C1CC(NCCN2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-11(2)12-9-13(10-12)14-5-8-15-6-3-4-7-15/h11-14H,3-10H2,1-2H3
InChIKeyXKLZBNGDWCFDCW-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds5

About 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine

3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine (PubChem CID 103560886) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine
PubChem CID103560886
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine
SMILESCC(C)C1CC(NCCN2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-11(2)12-9-13(10-12)14-5-8-15-6-3-4-7-15/h11-14H,3-10H2,1-2H3
InChIKeyXKLZBNGDWCFDCW-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(2-pyrrolidin-1-ylethyl)cyclobutane-1,3-diamine
CID 80559719
N-(2-pyrrolidin-1-ylethyl)cyclopropanamine
CID 54773109
1-N-[2-(azepan-1-yl)ethyl]cyclobutane-1,3-diamine
CID 80560908
tert-butyl 4-[2-[(3-propan-2-ylcyclobutyl)amino]ethyl]piperazine-1-carboxylate
CID 103578415
N-[2-(azepan-1-yl)ethyl]-3-methoxycyclobutan-1-amine
CID 104870840
N-[2-(azepan-1-yl)ethyl]cyclopropanamine
CID 54773126
3-propan-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclobutan-1-amine
CID 103561795
3-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 64501657
N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
N-[2-(4-methylpyrazol-1-yl)ethyl]-3-propan-2-ylcyclobutan-1-amine
CID 103578457
4-methyl-N-(2-pyrrolidin-1-ylethyl)cyclohexan-1-amine;dihydrochloride
CID 154577414
N-[2-(azepan-1-yl)ethyl]-3-phenylcyclobutan-1-amine
CID 61240000

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine?
The IUPAC name of 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine (CID 103560886) is 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine.
What is the SMILES notation for 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine?
The canonical SMILES for 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine is CC(C)C1CC(NCCN2CCCC2)C1.
What is the InChIKey of 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine?
The InChIKey is XKLZBNGDWCFDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11(2)12-9-13(10-12)14-5-8-15-6-3-4-7-15/h11-14H,3-10H2,1-2H3.
What are the key properties of 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine?
3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)cyclobutan-1-amine is sourced from PubChem (CID 103560886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).