2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine

C11H22N2 — CID 79678057

IUPAC2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine
SMILESCCCC1CN(C(CN)C2CC2)C1
InChIInChI=1S/C11H22N2/c1-2-3-9-7-13(8-9)11(6-12)10-4-5-10/h9-11H,2-8,12H2,1H3
InChIKeyKUTOIQILRXGFMW-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.46
Rot. Bonds5

About 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine

2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine (PubChem CID 79678057) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine
PubChem CID79678057
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine
SMILESCCCC1CN(C(CN)C2CC2)C1
InChIInChI=1S/C11H22N2/c1-2-3-9-7-13(8-9)11(6-12)10-4-5-10/h9-11H,2-8,12H2,1H3
InChIKeyKUTOIQILRXGFMW-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 82413998
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CID 43654999
2-(4-tert-butylcyclohexyl)-2-(3-ethylpyrrolidin-1-yl)ethanamine
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[1-(1-cyclopropylpropyl)pyrrolidin-3-yl]methanamine
CID 64918269
N-(cyclopentylmethyl)-1-(1-cyclopropylpropyl)-5-propylpiperidin-3-amine
CID 83998092
2-[5-amino-1-(1-cyclopropylpropyl)piperidin-3-yl]ethanol
CID 83989358
1-(1-cyclopropylpropyl)-5-methylpiperidin-3-amine
CID 79994121
cyclopropyl-(4-propylcyclohexyl)methanamine
CID 65424533
2-cyclopentyl-2-pyrrolidin-1-ylethanamine
CID 62071576
1-cyclopropyl-2-(3-propylazetidin-1-yl)ethanol
CID 104549602
2-(1-methylpiperidin-3-yl)-2-pyrrolidin-1-ylethanamine
CID 165347854
(2S)-2-(3-propylazetidin-1-yl)butan-1-ol
CID 107861581

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine?
The IUPAC name of 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine (CID 79678057) is 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine?
The canonical SMILES for 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine is CCCC1CN(C(CN)C2CC2)C1.
What is the InChIKey of 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine?
The InChIKey is KUTOIQILRXGFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-3-9-7-13(8-9)11(6-12)10-4-5-10/h9-11H,2-8,12H2,1H3.
What are the key properties of 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine?
2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine has a molecular weight of 182.31 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(3-propylazetidin-1-yl)ethanamine is sourced from PubChem (CID 79678057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).