3-(cyclopropylmethyl)azetidine

C7H13N — CID 62314893

IUPAC3-(cyclopropylmethyl)azetidine
SMILESC1CC1CC1CNC1
InChIInChI=1S/C7H13N/c1-2-6(1)3-7-4-8-5-7/h6-8H,1-5H2
InChIKeyLIGXSKXJILSUJT-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.01
Rot. Bonds2

About 3-(cyclopropylmethyl)azetidine

3-(cyclopropylmethyl)azetidine (PubChem CID 62314893) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 3-(cyclopropylmethyl)azetidine.

Molecular Properties

Compound Name3-(cyclopropylmethyl)azetidine
PubChem CID62314893
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name3-(cyclopropylmethyl)azetidine
SMILESC1CC1CC1CNC1
InChIInChI=1S/C7H13N/c1-2-6(1)3-7-4-8-5-7/h6-8H,1-5H2
InChIKeyLIGXSKXJILSUJT-UHFFFAOYSA-N
XLogP1.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(4-tert-butylcyclohexyl)methyl]azetidine
CID 104574692
3-[(4,4-dimethylcyclohexyl)methyl]azetidine
CID 130596177
4-(azetidin-3-ylmethyl)-1-(2,2-difluoroethyl)piperidine
CID 126573560
(3R)-3-(cyclopentylmethyl)piperidine
CID 94379259
4-(piperidin-4-ylmethyl)piperidine
CID 14123199
(3S)-3-(cyclohexylmethyl)pyrrolidine
CID 86324106
[4-(cyclopentylmethyl)cyclohexyl]methylcycloheptane
CID 140856779
4-(cyclopropylmethyl)cyclohexan-1-amine
CID 126845684
1-(azetidin-3-yl)-2-cyclopropylethanol
CID 105428286
3-[(4-methoxycyclohexyl)methyl]piperidine
CID 84734618
3-(cyclopropylmethyl)-4-methoxypyrrolidine
CID 84731345
cyclohexylmethylcyclohexane;piperazine
CID 174648338

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethyl)azetidine?
The IUPAC name of 3-(cyclopropylmethyl)azetidine (CID 62314893) is 3-(cyclopropylmethyl)azetidine.
What is the SMILES notation for 3-(cyclopropylmethyl)azetidine?
The canonical SMILES for 3-(cyclopropylmethyl)azetidine is C1CC1CC1CNC1.
What is the InChIKey of 3-(cyclopropylmethyl)azetidine?
The InChIKey is LIGXSKXJILSUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-2-6(1)3-7-4-8-5-7/h6-8H,1-5H2.
What are the key properties of 3-(cyclopropylmethyl)azetidine?
3-(cyclopropylmethyl)azetidine has a molecular weight of 111.19 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethyl)azetidine is sourced from PubChem (CID 62314893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).