(2S)-2-methyl-1-propan-2-ylazetidine

C7H15N — CID 118390770

IUPAC(2S)-2-methyl-1-propan-2-ylazetidine
SMILESCC(C)N1CC[C@@H]1C
InChIInChI=1S/C7H15N/c1-6(2)8-5-4-7(8)3/h6-7H,4-5H2,1-3H3/t7-/m0/s1
InChIKeyCQQJEEDAAJIWFK-ZETCQYMHSA-N
MW113.20 g/mol
LogP1.49
Rot. Bonds1

About (2S)-2-methyl-1-propan-2-ylazetidine

(2S)-2-methyl-1-propan-2-ylazetidine (PubChem CID 118390770) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is (2S)-2-methyl-1-propan-2-ylazetidine.

Molecular Properties

Compound Name(2S)-2-methyl-1-propan-2-ylazetidine
PubChem CID118390770
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name(2S)-2-methyl-1-propan-2-ylazetidine
SMILESCC(C)N1CC[C@@H]1C
InChIInChI=1S/C7H15N/c1-6(2)8-5-4-7(8)3/h6-7H,4-5H2,1-3H3/t7-/m0/s1
InChIKeyCQQJEEDAAJIWFK-ZETCQYMHSA-N
XLogP1.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2S)-2-methyl-1-propan-2-ylazetidine with MolForge

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

Launch Full Analysis

Related Compounds

1-Tert-butylazetidine
CID 336071
1-Propylazetidine
CID 550687
1-Isopropyl-azetidine
CID 23277878
1-Butyl-azetidine
CID 14088500
1,2-Dimethylazetidine
CID 287983
1-Chloro-2-methylazetidine
CID 535514
Ethylazetidine
CID 22153558
Azetidine, 2-methyl-1-(1-methylethyl)-
CID 287982
1-Isopropyl-3-methylazetidine
CID 287985
Trimethyl azetidine
CID 21553255
(2S)-1,2-dimethylazetidine
CID 90700177
(2S)-1,1,2-trimethylazetidin-1-ium
CID 134861978

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-1-propan-2-ylazetidine?
The IUPAC name of (2S)-2-methyl-1-propan-2-ylazetidine (CID 118390770) is (2S)-2-methyl-1-propan-2-ylazetidine.
What is the SMILES notation for (2S)-2-methyl-1-propan-2-ylazetidine?
The canonical SMILES for (2S)-2-methyl-1-propan-2-ylazetidine is CC(C)N1CC[C@@H]1C.
What is the InChIKey of (2S)-2-methyl-1-propan-2-ylazetidine?
The InChIKey is CQQJEEDAAJIWFK-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H15N/c1-6(2)8-5-4-7(8)3/h6-7H,4-5H2,1-3H3/t7-/m0/s1.
What are the key properties of (2S)-2-methyl-1-propan-2-ylazetidine?
(2S)-2-methyl-1-propan-2-ylazetidine has a molecular weight of 113.20 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-1-propan-2-ylazetidine is sourced from PubChem (CID 118390770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).