1-tert-butyl-2-(2-cyclopentylpropyl)azetidine

C15H29N — CID 155088555

IUPAC1-tert-butyl-2-(2-cyclopentylpropyl)azetidine
SMILESCC(CC1CCN1C(C)(C)C)C1CCCC1
InChIInChI=1S/C15H29N/c1-12(13-7-5-6-8-13)11-14-9-10-16(14)15(2,3)4/h12-14H,5-11H2,1-4H3
InChIKeyMINCVPTUAJPFFO-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.08
Rot. Bonds3

About 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine

1-tert-butyl-2-(2-cyclopentylpropyl)azetidine (PubChem CID 155088555) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine.

Molecular Properties

Compound Name1-tert-butyl-2-(2-cyclopentylpropyl)azetidine
PubChem CID155088555
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-tert-butyl-2-(2-cyclopentylpropyl)azetidine
SMILESCC(CC1CCN1C(C)(C)C)C1CCCC1
InChIInChI=1S/C15H29N/c1-12(13-7-5-6-8-13)11-14-9-10-16(14)15(2,3)4/h12-14H,5-11H2,1-4H3
InChIKeyMINCVPTUAJPFFO-UHFFFAOYSA-N
XLogP4.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1-tert-butylpiperidin-2-yl)methanamine
CID 67209205
1-cyclopentylpropan-2-ylcyclopentane
CID 57131610
1-tert-butyl-2-(methoxymethyl)azetidine
CID 14509066
1-tert-butyl-2-(fluoromethyl)piperidine
CID 171453847
(1-tert-butylazepan-2-yl)methanol
CID 84660252
1-tert-butyl-2-propylpiperidine
CID 59028554
1-(1-tert-butylpiperidin-2-yl)-N,N-dimethylmethanamine
CID 21132217
2-(1-tert-butylazepan-2-yl)ethanamine
CID 84668474
butan-2-ylcyclohexadecane
CID 123713671
2-cyclopropylpropylcyclobutane
CID 54087952
butan-2-ylcyclopentane;ethane
CID 143236269
5-cyclopentyl-2,2-dimethylhexan-3-ol
CID 57260402

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine?
The IUPAC name of 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine (CID 155088555) is 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine.
What is the SMILES notation for 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine?
The canonical SMILES for 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine is CC(CC1CCN1C(C)(C)C)C1CCCC1.
What is the InChIKey of 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine?
The InChIKey is MINCVPTUAJPFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-12(13-7-5-6-8-13)11-14-9-10-16(14)15(2,3)4/h12-14H,5-11H2,1-4H3.
What are the key properties of 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine?
1-tert-butyl-2-(2-cyclopentylpropyl)azetidine has a molecular weight of 223.40 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-2-(2-cyclopentylpropyl)azetidine is sourced from PubChem (CID 155088555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).