3-(dimethylamino)propan-1-ol;hydrochloride

C5H14ClNO — CID 18784220

IUPAC3-(dimethylamino)propan-1-ol;hydrochloride
SMILESCN(C)CCCO.Cl
InChIInChI=1S/C5H13NO.ClH/c1-6(2)4-3-5-7;/h7H,3-5H2,1-2H3;1H
InChIKeyWUMJCTFQUXKJOM-UHFFFAOYSA-N
MW139.63 g/mol
LogP0.35
Rot. Bonds3

About 3-(dimethylamino)propan-1-ol;hydrochloride

3-(dimethylamino)propan-1-ol;hydrochloride (PubChem CID 18784220) has the molecular formula C5H14ClNO and a molecular weight of 139.63 g/mol. Its IUPAC name is 3-(dimethylamino)propan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-(dimethylamino)propan-1-ol;hydrochloride
PubChem CID18784220
Molecular FormulaC5H14ClNO
Molecular Weight139.63 g/mol
Exact Mass139.08
IUPAC Name3-(dimethylamino)propan-1-ol;hydrochloride
SMILESCN(C)CCCO.Cl
InChIInChI=1S/C5H13NO.ClH/c1-6(2)4-3-5-7;/h7H,3-5H2,1-2H3;1H
InChIKeyWUMJCTFQUXKJOM-UHFFFAOYSA-N
XLogP0.35
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.63
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)propan-1-ol;hydrochloride?
The IUPAC name of 3-(dimethylamino)propan-1-ol;hydrochloride (CID 18784220) is 3-(dimethylamino)propan-1-ol;hydrochloride.
What is the SMILES notation for 3-(dimethylamino)propan-1-ol;hydrochloride?
The canonical SMILES for 3-(dimethylamino)propan-1-ol;hydrochloride is CN(C)CCCO.Cl.
What is the InChIKey of 3-(dimethylamino)propan-1-ol;hydrochloride?
The InChIKey is WUMJCTFQUXKJOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO.ClH/c1-6(2)4-3-5-7;/h7H,3-5H2,1-2H3;1H.
What are the key properties of 3-(dimethylamino)propan-1-ol;hydrochloride?
3-(dimethylamino)propan-1-ol;hydrochloride has a molecular weight of 139.63 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)propan-1-ol;hydrochloride is sourced from PubChem (CID 18784220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).