2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine

C9H20N2 — CID 105430583

IUPAC2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine
SMILESCC(C)(C)C(CN)N1CCC1
InChIInChI=1S/C9H20N2/c1-9(2,3)8(7-10)11-5-4-6-11/h8H,4-7,10H2,1-3H3
InChIKeyOGVQUGPBCQSARG-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.07
Rot. Bonds2

About 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine

2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine (PubChem CID 105430583) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine
PubChem CID105430583
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine
SMILESCC(C)(C)C(CN)N1CCC1
InChIInChI=1S/C9H20N2/c1-9(2,3)8(7-10)11-5-4-6-11/h8H,4-7,10H2,1-3H3
InChIKeyOGVQUGPBCQSARG-UHFFFAOYSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1,1-dioxo-1,4-thiazinan-4-yl)-3,3-dimethylbutan-1-amine
CID 61324957
(2R)-2-(azetidin-1-yl)-3,3,3-trifluoropropan-1-amine
CID 86327569
4-(1-amino-3,3-dimethylbutan-2-yl)-1,4-diazepan-2-one
CID 65361617
1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpyrrolidin-3-ol
CID 103355425
1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol
CID 114677908
4-(1-amino-3,3-dimethylbutan-2-yl)-1-methylpiperazin-2-one
CID 64682377
2-(1,3-dihydroisoindol-2-yl)-3,3-dimethylbutan-1-amine
CID 62205880
2-[4-(2-fluorophenyl)piperazin-1-yl]-3,3-dimethylbutan-1-amine
CID 61325786
3,3-dimethyl-2-(2-methylazetidin-1-yl)butan-1-amine
CID 130483921
3-(azetidin-1-yl)-2,2-dimethylbutan-1-amine
CID 115012199
1-(2,2-dimethylundecan-3-yl)pyrrolidine
CID 150582277
3,3-dimethyl-2-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-amine
CID 63171723

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine?
The IUPAC name of 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine (CID 105430583) is 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine.
What is the SMILES notation for 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine?
The canonical SMILES for 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine is CC(C)(C)C(CN)N1CCC1.
What is the InChIKey of 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine?
The InChIKey is OGVQUGPBCQSARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-9(2,3)8(7-10)11-5-4-6-11/h8H,4-7,10H2,1-3H3.
What are the key properties of 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine?
2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine is sourced from PubChem (CID 105430583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).