3-(1-tert-butylazetidin-2-yl)propan-1-amine

C10H22N2 — CID 84653909

IUPAC3-(1-tert-butylazetidin-2-yl)propan-1-amine
SMILESCC(C)(C)N1CCC1CCCN
InChIInChI=1S/C10H22N2/c1-10(2,3)12-8-6-9(12)5-4-7-11/h9H,4-8,11H2,1-3H3
InChIKeyRYFFPRQXSQUPPS-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.60
Rot. Bonds3

About 3-(1-tert-butylazetidin-2-yl)propan-1-amine

3-(1-tert-butylazetidin-2-yl)propan-1-amine (PubChem CID 84653909) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 3-(1-tert-butylazetidin-2-yl)propan-1-amine.

Molecular Properties

Compound Name3-(1-tert-butylazetidin-2-yl)propan-1-amine
PubChem CID84653909
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name3-(1-tert-butylazetidin-2-yl)propan-1-amine
SMILESCC(C)(C)N1CCC1CCCN
InChIInChI=1S/C10H22N2/c1-10(2,3)12-8-6-9(12)5-4-7-11/h9H,4-8,11H2,1-3H3
InChIKeyRYFFPRQXSQUPPS-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-tert-butylazepan-2-yl)ethanamine
CID 84668474
(1-tert-butylpiperidin-2-yl)methanamine
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1-tert-butyl-2-(methoxymethyl)azetidine
CID 14509066
(2R)-1-tert-butyl-2-propylpyrrolidine
CID 126550968
(2S)-1-tert-butyl-2-propylpyrrolidine
CID 126658078
1-tert-butyl-2-propylpiperidine
CID 59028554
3-(1-ethylpyrrolidin-2-yl)propan-1-amine
CID 63763897
3-[1-(1-amino-2-methylpropan-2-yl)pyrrolidin-2-yl]propan-1-ol
CID 104523176
1-tert-butyl-2-(2-cyclopentylpropyl)azetidine
CID 155088555
tert-butyl (2R)-2-(3-aminopropyl)piperidine-1-carboxylate
CID 34178148
1,4-ditert-butyl-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrole
CID 164706292
(3R)-3-(aminomethyl)-1-tert-butylpyrrolidine-2-carboxylic acid
CID 66578004

Frequently Asked Questions

What is the IUPAC name of 3-(1-tert-butylazetidin-2-yl)propan-1-amine?
The IUPAC name of 3-(1-tert-butylazetidin-2-yl)propan-1-amine (CID 84653909) is 3-(1-tert-butylazetidin-2-yl)propan-1-amine.
What is the SMILES notation for 3-(1-tert-butylazetidin-2-yl)propan-1-amine?
The canonical SMILES for 3-(1-tert-butylazetidin-2-yl)propan-1-amine is CC(C)(C)N1CCC1CCCN.
What is the InChIKey of 3-(1-tert-butylazetidin-2-yl)propan-1-amine?
The InChIKey is RYFFPRQXSQUPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2,3)12-8-6-9(12)5-4-7-11/h9H,4-8,11H2,1-3H3.
What are the key properties of 3-(1-tert-butylazetidin-2-yl)propan-1-amine?
3-(1-tert-butylazetidin-2-yl)propan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-tert-butylazetidin-2-yl)propan-1-amine is sourced from PubChem (CID 84653909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).