3-[methyl(propyl)amino]hexan-1-ol

C10H23NO — CID 91433041

IUPAC3-[methyl(propyl)amino]hexan-1-ol
SMILESCCCC(CCO)N(C)CCC
InChIInChI=1S/C10H23NO/c1-4-6-10(7-9-12)11(3)8-5-2/h10,12H,4-9H2,1-3H3
InChIKeyNONWVTLFFVTBFB-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.88
Rot. Bonds7

About 3-[methyl(propyl)amino]hexan-1-ol

3-[methyl(propyl)amino]hexan-1-ol (PubChem CID 91433041) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 3-[methyl(propyl)amino]hexan-1-ol.

Molecular Properties

Compound Name3-[methyl(propyl)amino]hexan-1-ol
PubChem CID91433041
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name3-[methyl(propyl)amino]hexan-1-ol
SMILESCCCC(CCO)N(C)CCC
InChIInChI=1S/C10H23NO/c1-4-6-10(7-9-12)11(3)8-5-2/h10,12H,4-9H2,1-3H3
InChIKeyNONWVTLFFVTBFB-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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Related Compounds

4-[heptan-4-yl(methyl)amino]butan-1-ol
CID 88539723
2-[hexacosan-13-yl(methyl)amino]ethanol
CID 87981075
1-N-heptan-4-yl-1-N,4-dimethylpentane-1,3-diamine
CID 115317385
N-butyl-N-methylnonan-5-amine
CID 175231488
1-[methyl(propyl)amino]propan-1-ol
CID 118973060
2-[hexan-3-yl(methyl)amino]ethanesulfonic acid
CID 142409189
2-[[bis(2-hydroxyethyl)amino]-propylamino]ethanol
CID 118332539
N,N-dimethylheptan-4-amine;hydrochloride
CID 138400485
3-N-ethyl-3-N-methylhexane-1,3-diamine
CID 59020922
2-N-methyl-2-N-pentyl-1-N-propan-2-ylpentane-1,2-diamine
CID 83054356
1-N-tert-butyl-2-N-butyl-2-N-methylpentane-1,2-diamine
CID 83042715
1-methoxy-3-[methyl(propyl)amino]hexan-2-one
CID 59873060

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(propyl)amino]hexan-1-ol?
The IUPAC name of 3-[methyl(propyl)amino]hexan-1-ol (CID 91433041) is 3-[methyl(propyl)amino]hexan-1-ol.
What is the SMILES notation for 3-[methyl(propyl)amino]hexan-1-ol?
The canonical SMILES for 3-[methyl(propyl)amino]hexan-1-ol is CCCC(CCO)N(C)CCC.
What is the InChIKey of 3-[methyl(propyl)amino]hexan-1-ol?
The InChIKey is NONWVTLFFVTBFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-6-10(7-9-12)11(3)8-5-2/h10,12H,4-9H2,1-3H3.
What are the key properties of 3-[methyl(propyl)amino]hexan-1-ol?
3-[methyl(propyl)amino]hexan-1-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 3-[methyl(propyl)amino]hexan-1-ol is sourced from PubChem (CID 91433041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).