methanol;1-propylpiperidine

C9H21NO — CID 171515121

IUPACmethanol;1-propylpiperidine
SMILESCCCN1CCCCC1.CO
InChIInChI=1S/C8H17N.CH4O/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H2,1H3;2H,1H3
InChIKeyMIAGCECKIQFGKO-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.49
Rot. Bonds2

About methanol;1-propylpiperidine

methanol;1-propylpiperidine (PubChem CID 171515121) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is methanol;1-propylpiperidine.

Molecular Properties

Compound Namemethanol;1-propylpiperidine
PubChem CID171515121
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Namemethanol;1-propylpiperidine
SMILESCCCN1CCCCC1.CO
InChIInChI=1S/C8H17N.CH4O/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H2,1H3;2H,1H3
InChIKeyMIAGCECKIQFGKO-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-propylpyrrolidine;hydrobromide
CID 173024709
1-propyl-4-(2-pyrrolidin-1-ylethyl)piperazine
CID 135208810
tetrakis(carbonofluoridic acid);tetrakis(1-propylpyrrolidine)
CID 173154701
piperidine;1-propylpiperidine
CID 67843364
prop-1-ene;1-propylpyrrolidine
CID 143531885
butane;2-methylbutane;1-propylpyrrolidine
CID 161374210
propan-1-ol;2-pyrrolidin-1-ylethanol
CID 174908040
1-dodecylazepane
CID 3366129
1-decylpiperidine
CID 4649960
1-octylazonane
CID 20533821
1-(2,2-dimethylpropyl)azetidine;ethane;1-propylpyrrolidine
CID 142420911
1-butylpiperidine;hexane;1-hexylpiperidine
CID 156727490

Frequently Asked Questions

What is the IUPAC name of methanol;1-propylpiperidine?
The IUPAC name of methanol;1-propylpiperidine (CID 171515121) is methanol;1-propylpiperidine.
What is the SMILES notation for methanol;1-propylpiperidine?
The canonical SMILES for methanol;1-propylpiperidine is CCCN1CCCCC1.CO.
What is the InChIKey of methanol;1-propylpiperidine?
The InChIKey is MIAGCECKIQFGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.CH4O/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H2,1H3;2H,1H3.
What are the key properties of methanol;1-propylpiperidine?
methanol;1-propylpiperidine has a molecular weight of 159.27 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1-propylpiperidine is sourced from PubChem (CID 171515121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).