3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol

C10H23NO — CID 62270214

IUPAC3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol
SMILESCCCN(CC)CC(C)(C)CO
InChIInChI=1S/C10H23NO/c1-5-7-11(6-2)8-10(3,4)9-12/h12H,5-9H2,1-4H3
InChIKeyVXYHAQUIOSZBNW-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.74
Rot. Bonds6

About 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol

3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol (PubChem CID 62270214) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol.

Molecular Properties

Compound Name3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol
PubChem CID62270214
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol
SMILESCCCN(CC)CC(C)(C)CO
InChIInChI=1S/C10H23NO/c1-5-7-11(6-2)8-10(3,4)9-12/h12H,5-9H2,1-4H3
InChIKeyVXYHAQUIOSZBNW-UHFFFAOYSA-N
XLogP1.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol?
The IUPAC name of 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol (CID 62270214) is 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol.
What is the SMILES notation for 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol?
The canonical SMILES for 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol is CCCN(CC)CC(C)(C)CO.
What is the InChIKey of 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol?
The InChIKey is VXYHAQUIOSZBNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-7-11(6-2)8-10(3,4)9-12/h12H,5-9H2,1-4H3.
What are the key properties of 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol?
3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol has a molecular weight of 173.30 g/mol, XLogP of 1.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(propyl)amino]-2,2-dimethylpropan-1-ol is sourced from PubChem (CID 62270214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).