4-(2-aminopropyl)-1-methylpiperidin-4-ol

C9H20N2O — CID 15639443

IUPAC4-(2-aminopropyl)-1-methylpiperidin-4-ol
SMILESCC(N)CC1(O)CCN(C)CC1
InChIInChI=1S/C9H20N2O/c1-8(10)7-9(12)3-5-11(2)6-4-9/h8,12H,3-7,10H2,1-2H3
InChIKeyDKKWLJUVJATCGR-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.18
Rot. Bonds2

About 4-(2-aminopropyl)-1-methylpiperidin-4-ol

4-(2-aminopropyl)-1-methylpiperidin-4-ol (PubChem CID 15639443) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 4-(2-aminopropyl)-1-methylpiperidin-4-ol.

Molecular Properties

Compound Name4-(2-aminopropyl)-1-methylpiperidin-4-ol
PubChem CID15639443
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name4-(2-aminopropyl)-1-methylpiperidin-4-ol
SMILESCC(N)CC1(O)CCN(C)CC1
InChIInChI=1S/C9H20N2O/c1-8(10)7-9(12)3-5-11(2)6-4-9/h8,12H,3-7,10H2,1-2H3
InChIKeyDKKWLJUVJATCGR-UHFFFAOYSA-N
XLogP0.18
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Aminomethyl)-1-(propan-2-yl)piperidin-4-ol
CID 21643904
4-[2-(Dimethylamino)ethyl]piperidin-4-ol
CID 84050274
1-[3-(1-Aminoethyl)piperidin-1-yl]-2-methylpropan-2-ol hydrochloride
CID 71758417
4-Ethyl-2,5-dimethyl-4-piperidinol
CID 20496650
1,2,4-Trimethylpiperid-4-ol
CID 81611310
1,2,3,4-Tetramethylpiperid-4-ol
CID 129804205
4-(2-Fluoro-2-methylpropyl)piperidin-4-ol
CID 90419028
1,2,4,5-Tetramethylpiperid-4-ol
CID 129804131
1-[3-(1-Aminoethyl)piperidin-1-yl]-2-methylpropan-2-ol
CID 63848903
1-Amino-2-methyl-4-[4-(trifluoromethyl)piperidin-1-yl]pentan-2-ol
CID 65545708
1-(4-Amino-1,1,1-trifluorobutan-2-yl)-4-methylpiperidin-4-ol
CID 81096659
4-Ethyl-1,2,5-trimethylpiperidin-4-ol
CID 2827413

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-1-methylpiperidin-4-ol?
The IUPAC name of 4-(2-aminopropyl)-1-methylpiperidin-4-ol (CID 15639443) is 4-(2-aminopropyl)-1-methylpiperidin-4-ol.
What is the SMILES notation for 4-(2-aminopropyl)-1-methylpiperidin-4-ol?
The canonical SMILES for 4-(2-aminopropyl)-1-methylpiperidin-4-ol is CC(N)CC1(O)CCN(C)CC1.
What is the InChIKey of 4-(2-aminopropyl)-1-methylpiperidin-4-ol?
The InChIKey is DKKWLJUVJATCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-8(10)7-9(12)3-5-11(2)6-4-9/h8,12H,3-7,10H2,1-2H3.
What are the key properties of 4-(2-aminopropyl)-1-methylpiperidin-4-ol?
4-(2-aminopropyl)-1-methylpiperidin-4-ol has a molecular weight of 172.27 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-1-methylpiperidin-4-ol is sourced from PubChem (CID 15639443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).