1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine

C15H29N3 — CID 166559631

IUPAC1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine
SMILESCC(C)C1CN(C2CN(C3CN(C(C)C)C3)C2)C1
InChIInChI=1S/C15H29N3/c1-11(2)13-5-17(6-13)15-9-18(10-15)14-7-16(8-14)12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyLBQDBXSHOMCGJK-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.35
Rot. Bonds4

About 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine

1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine (PubChem CID 166559631) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine.

Molecular Properties

Compound Name1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine
PubChem CID166559631
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine
SMILESCC(C)C1CN(C2CN(C3CN(C(C)C)C3)C2)C1
InChIInChI=1S/C15H29N3/c1-11(2)13-5-17(6-13)15-9-18(10-15)14-7-16(8-14)12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyLBQDBXSHOMCGJK-UHFFFAOYSA-N
XLogP1.35
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine?
The IUPAC name of 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine (CID 166559631) is 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine.
What is the SMILES notation for 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine?
The canonical SMILES for 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine is CC(C)C1CN(C2CN(C3CN(C(C)C)C3)C2)C1.
What is the InChIKey of 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine?
The InChIKey is LBQDBXSHOMCGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-11(2)13-5-17(6-13)15-9-18(10-15)14-7-16(8-14)12(3)4/h11-15H,5-10H2,1-4H3.
What are the key properties of 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine?
1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine has a molecular weight of 251.42 g/mol, XLogP of 1.35, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-3-[3-(3-propan-2-ylazetidin-1-yl)azetidin-1-yl]azetidine is sourced from PubChem (CID 166559631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).