1-cycloheptyl-3-cyclopropylazetidin-3-amine

C13H24N2 — CID 82925594

IUPAC1-cycloheptyl-3-cyclopropylazetidin-3-amine
SMILESNC1(C2CC2)CN(C2CCCCCC2)C1
InChIInChI=1S/C13H24N2/c14-13(11-7-8-11)9-15(10-13)12-5-3-1-2-4-6-12/h11-12H,1-10,14H2
InChIKeyTXIKEHDHZWRSJY-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.13
Rot. Bonds2

About 1-cycloheptyl-3-cyclopropylazetidin-3-amine

1-cycloheptyl-3-cyclopropylazetidin-3-amine (PubChem CID 82925594) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-cycloheptyl-3-cyclopropylazetidin-3-amine.

Molecular Properties

Compound Name1-cycloheptyl-3-cyclopropylazetidin-3-amine
PubChem CID82925594
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name1-cycloheptyl-3-cyclopropylazetidin-3-amine
SMILESNC1(C2CC2)CN(C2CCCCCC2)C1
InChIInChI=1S/C13H24N2/c14-13(11-7-8-11)9-15(10-13)12-5-3-1-2-4-6-12/h11-12H,1-10,14H2
InChIKeyTXIKEHDHZWRSJY-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-3-cyclopropylazetidin-3-amine?
The IUPAC name of 1-cycloheptyl-3-cyclopropylazetidin-3-amine (CID 82925594) is 1-cycloheptyl-3-cyclopropylazetidin-3-amine.
What is the SMILES notation for 1-cycloheptyl-3-cyclopropylazetidin-3-amine?
The canonical SMILES for 1-cycloheptyl-3-cyclopropylazetidin-3-amine is NC1(C2CC2)CN(C2CCCCCC2)C1.
What is the InChIKey of 1-cycloheptyl-3-cyclopropylazetidin-3-amine?
The InChIKey is TXIKEHDHZWRSJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c14-13(11-7-8-11)9-15(10-13)12-5-3-1-2-4-6-12/h11-12H,1-10,14H2.
What are the key properties of 1-cycloheptyl-3-cyclopropylazetidin-3-amine?
1-cycloheptyl-3-cyclopropylazetidin-3-amine has a molecular weight of 208.35 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-3-cyclopropylazetidin-3-amine is sourced from PubChem (CID 82925594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).