1-(dipropylamino)butan-2-ol

C10H23NO — CID 3301252

IUPAC1-(dipropylamino)butan-2-ol
SMILESCCCN(CCC)CC(O)CC
InChIInChI=1S/C10H23NO/c1-4-7-11(8-5-2)9-10(12)6-3/h10,12H,4-9H2,1-3H3
InChIKeySVAFAARLUVWPAQ-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.88
Rot. Bonds7

About 1-(dipropylamino)butan-2-ol

1-(dipropylamino)butan-2-ol (PubChem CID 3301252) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 1-(dipropylamino)butan-2-ol.

Molecular Properties

Compound Name1-(dipropylamino)butan-2-ol
PubChem CID3301252
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name1-(dipropylamino)butan-2-ol
SMILESCCCN(CCC)CC(O)CC
InChIInChI=1S/C10H23NO/c1-4-7-11(8-5-2)9-10(12)6-3/h10,12H,4-9H2,1-3H3
InChIKeySVAFAARLUVWPAQ-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(dipropylamino)butan-2-ol?
The IUPAC name of 1-(dipropylamino)butan-2-ol (CID 3301252) is 1-(dipropylamino)butan-2-ol.
What is the SMILES notation for 1-(dipropylamino)butan-2-ol?
The canonical SMILES for 1-(dipropylamino)butan-2-ol is CCCN(CCC)CC(O)CC.
What is the InChIKey of 1-(dipropylamino)butan-2-ol?
The InChIKey is SVAFAARLUVWPAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-7-11(8-5-2)9-10(12)6-3/h10,12H,4-9H2,1-3H3.
What are the key properties of 1-(dipropylamino)butan-2-ol?
1-(dipropylamino)butan-2-ol has a molecular weight of 173.30 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dipropylamino)butan-2-ol is sourced from PubChem (CID 3301252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).