3-[methyl(piperidin-4-yl)amino]propan-1-ol

C9H20N2O — CID 12019499

IUPAC3-[methyl(piperidin-4-yl)amino]propan-1-ol
SMILESCN(CCCO)C1CCNCC1
InChIInChI=1S/C9H20N2O/c1-11(7-2-8-12)9-3-5-10-6-4-9/h9-10,12H,2-8H2,1H3
InChIKeyRSMGBDMEDZHITB-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.05
Rot. Bonds4

About 3-[methyl(piperidin-4-yl)amino]propan-1-ol

3-[methyl(piperidin-4-yl)amino]propan-1-ol (PubChem CID 12019499) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-[methyl(piperidin-4-yl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[methyl(piperidin-4-yl)amino]propan-1-ol
PubChem CID12019499
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-[methyl(piperidin-4-yl)amino]propan-1-ol
SMILESCN(CCCO)C1CCNCC1
InChIInChI=1S/C9H20N2O/c1-11(7-2-8-12)9-3-5-10-6-4-9/h9-10,12H,2-8H2,1H3
InChIKeyRSMGBDMEDZHITB-UHFFFAOYSA-N
XLogP0.05
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-dimethyl-N,N'-di(piperidin-4-yl)ethane-1,2-diamine;tetrahydrochloride
CID 18770418
N-butyl-N-methylpiperidin-4-amine;dihydrochloride
CID 53410849
N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine
CID 115514843
6-[cyclopropyl(methyl)amino]hexan-1-ol
CID 103737798
5-[cyclopentyl(methyl)amino]pentan-1-ol
CID 62227665
N-methyl-N-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 64567145
3-[methyl-(1-oxothian-4-yl)amino]propan-1-ol
CID 111543956
4-[3-hydroxypropyl(methyl)amino]cyclohexan-1-one
CID 79120512
2-[2-[azepan-4-yl(methyl)amino]ethoxy]ethanol
CID 107173264
N'-cyclohexyl-N'-methyl-N-(piperidin-4-ylmethyl)propane-1,3-diamine
CID 79707936
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-methylpiperidin-4-amine
CID 104565100
N,4-dimethyl-N-(3-piperidin-4-ylpropyl)cyclohexan-1-amine
CID 62212511

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(piperidin-4-yl)amino]propan-1-ol?
The IUPAC name of 3-[methyl(piperidin-4-yl)amino]propan-1-ol (CID 12019499) is 3-[methyl(piperidin-4-yl)amino]propan-1-ol.
What is the SMILES notation for 3-[methyl(piperidin-4-yl)amino]propan-1-ol?
The canonical SMILES for 3-[methyl(piperidin-4-yl)amino]propan-1-ol is CN(CCCO)C1CCNCC1.
What is the InChIKey of 3-[methyl(piperidin-4-yl)amino]propan-1-ol?
The InChIKey is RSMGBDMEDZHITB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-11(7-2-8-12)9-3-5-10-6-4-9/h9-10,12H,2-8H2,1H3.
What are the key properties of 3-[methyl(piperidin-4-yl)amino]propan-1-ol?
3-[methyl(piperidin-4-yl)amino]propan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(piperidin-4-yl)amino]propan-1-ol is sourced from PubChem (CID 12019499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).