1-[3-(dimethylamino)propyl]azetidin-3-ol

C8H18N2O — CID 115773117

IUPAC1-[3-(dimethylamino)propyl]azetidin-3-ol
SMILESCN(C)CCCN1CC(O)C1
InChIInChI=1S/C8H18N2O/c1-9(2)4-3-5-10-6-8(11)7-10/h8,11H,3-7H2,1-2H3
InChIKeyDJNRHHHKUJGGGZ-UHFFFAOYSA-N
MW158.25 g/mol
LogP-0.39
Rot. Bonds4

About 1-[3-(dimethylamino)propyl]azetidin-3-ol

1-[3-(dimethylamino)propyl]azetidin-3-ol (PubChem CID 115773117) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is 1-[3-(dimethylamino)propyl]azetidin-3-ol.

Molecular Properties

Compound Name1-[3-(dimethylamino)propyl]azetidin-3-ol
PubChem CID115773117
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name1-[3-(dimethylamino)propyl]azetidin-3-ol
SMILESCN(C)CCCN1CC(O)C1
InChIInChI=1S/C8H18N2O/c1-9(2)4-3-5-10-6-8(11)7-10/h8,11H,3-7H2,1-2H3
InChIKeyDJNRHHHKUJGGGZ-UHFFFAOYSA-N
XLogP-0.39
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(dimethylamino)propyl]piperidin-4-ol
CID 82075263
3-(aziridin-1-yl)-N,N-dimethylpropan-1-amine
CID 154296752
3-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-N,N-dimethylpropan-1-amine
CID 58591136
1-[3-(dimethylamino)propyl]-5,5-dimethylpyrrolidin-3-ol
CID 117017918
2-[3,5-bis[3-(dimethylamino)propyl]-1,3,5-triazinan-1-yl]ethanol
CID 57224817
1-(6-hydroxyhexyl)azetidin-3-ol
CID 107706453
N,N-dimethyl-3-(4-methylpiperazin-1-yl)propan-1-amine
CID 13330581
(3R)-1-[3-(dimethylamino)propyl]pyrrolidin-3-amine
CID 92916692
1-(4-methoxybutyl)azetidin-3-ol
CID 115773115
methyl 1-[3-(dimethylamino)propyl]-4-methylpyrrolidine-3-carboxylate
CID 115688743
N,N-dimethyl-3-[(3R)-3-methylpiperazin-1-yl]propan-1-amine
CID 95436399
N-[3-[3,5-bis[3-(dimethylamino)propyl]-1,3,5-triazinan-1-yl]propyl]-N-methylthiohydroxylamine
CID 138569345

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)propyl]azetidin-3-ol?
The IUPAC name of 1-[3-(dimethylamino)propyl]azetidin-3-ol (CID 115773117) is 1-[3-(dimethylamino)propyl]azetidin-3-ol.
What is the SMILES notation for 1-[3-(dimethylamino)propyl]azetidin-3-ol?
The canonical SMILES for 1-[3-(dimethylamino)propyl]azetidin-3-ol is CN(C)CCCN1CC(O)C1.
What is the InChIKey of 1-[3-(dimethylamino)propyl]azetidin-3-ol?
The InChIKey is DJNRHHHKUJGGGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-9(2)4-3-5-10-6-8(11)7-10/h8,11H,3-7H2,1-2H3.
What are the key properties of 1-[3-(dimethylamino)propyl]azetidin-3-ol?
1-[3-(dimethylamino)propyl]azetidin-3-ol has a molecular weight of 158.25 g/mol, XLogP of -0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)propyl]azetidin-3-ol is sourced from PubChem (CID 115773117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).