1-propan-2-ylazetidin-3-amine

C6H14N2 — CID 15636936

IUPAC1-propan-2-ylazetidin-3-amine
SMILESCC(C)N1CC(N)C1
InChIInChI=1S/C6H14N2/c1-5(2)8-3-6(7)4-8/h5-6H,3-4,7H2,1-2H3
InChIKeyNORUUYRXMOOAHX-UHFFFAOYSA-N
MW114.19 g/mol
LogP0.04
Rot. Bonds1

About 1-propan-2-ylazetidin-3-amine

1-propan-2-ylazetidin-3-amine (PubChem CID 15636936) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 1-propan-2-ylazetidin-3-amine.

Molecular Properties

Compound Name1-propan-2-ylazetidin-3-amine
PubChem CID15636936
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name1-propan-2-ylazetidin-3-amine
SMILESCC(C)N1CC(N)C1
InChIInChI=1S/C6H14N2/c1-5(2)8-3-6(7)4-8/h5-6H,3-4,7H2,1-2H3
InChIKeyNORUUYRXMOOAHX-UHFFFAOYSA-N
XLogP0.04
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Amino-1-dimethylaminopropane
CID 99027
(1-Tert-butylazetidin-2-yl)methanamine
CID 282395
1-Azetidineethanamine
CID 15636950
N,N-dimethylazetidin-3-amine
CID 10351656
1-Methylazetidin-3-amine
CID 18712662
((2S)-2-aminopropyl)dimethylamine
CID 11126193
[(2R)-2-aminopropyl]dimethylamine
CID 11430749
(1-Ethylazetidin-2-yl)methanamine
CID 15028163
1-(Propan-2-yl)azetidin-3-amine dihydrochloride
CID 15636937
N,N-diethylazetidin-3-amine dihydrochloride
CID 19423807
N-ethylazetidin-3-amine dihydrochloride
CID 22121198
N,N-dimethylazetidin-3-amine dihydrochloride
CID 22121220

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-ylazetidin-3-amine?
The IUPAC name of 1-propan-2-ylazetidin-3-amine (CID 15636936) is 1-propan-2-ylazetidin-3-amine.
What is the SMILES notation for 1-propan-2-ylazetidin-3-amine?
The canonical SMILES for 1-propan-2-ylazetidin-3-amine is CC(C)N1CC(N)C1.
What is the InChIKey of 1-propan-2-ylazetidin-3-amine?
The InChIKey is NORUUYRXMOOAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-5(2)8-3-6(7)4-8/h5-6H,3-4,7H2,1-2H3.
What are the key properties of 1-propan-2-ylazetidin-3-amine?
1-propan-2-ylazetidin-3-amine has a molecular weight of 114.19 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylazetidin-3-amine is sourced from PubChem (CID 15636936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).