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

C12H26N2O — CID 62221672

IUPAC4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol
SMILESCCC(CC)N(C)CC1(O)CCNCC1
InChIInChI=1S/C12H26N2O/c1-4-11(5-2)14(3)10-12(15)6-8-13-9-7-12/h11,13,15H,4-10H2,1-3H3
InChIKeyHEPXYZORUGKZJW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.22
Rot. Bonds5

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

4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol (PubChem CID 62221672) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol
PubChem CID62221672
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol
SMILESCCC(CC)N(C)CC1(O)CCNCC1
InChIInChI=1S/C12H26N2O/c1-4-11(5-2)14(3)10-12(15)6-8-13-9-7-12/h11,13,15H,4-10H2,1-3H3
InChIKeyHEPXYZORUGKZJW-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(Aminomethyl)-1-methylpiperidin-4-ol
CID 6484262
1-Methyl-4-((methylamino)methyl)piperidin-4-ol
CID 14153814
4-((Dimethylamino)methyl)-4-piperidinol dihydrochloride
CID 19382216
4-(Aminomethyl)-1-(propan-2-yl)piperidin-4-ol
CID 21643904
4-[2-(Dimethylamino)ethyl]piperidin-4-ol
CID 84050274
4-(1-Pyrrolidinylmethyl)-4-piperidinol
CID 28065054
1-(4-Aminopiperidin-1-yl)-2-methylpropan-2-ol
CID 50986512
1-[3-(1-Aminoethyl)piperidin-1-yl]-2-methylpropan-2-ol hydrochloride
CID 71758417
3-Methyl-2-(piperazin-2-yl)butan-2-ol
CID 66806031
4-((Dimethylamino)methyl)piperidin-4-ol
CID 14578470
2-(Piperazin-2-yl)propan-2-ol
CID 55299566
4-[[Cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol
CID 55048343

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol?
The IUPAC name of 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol (CID 62221672) is 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol.
What is the SMILES notation for 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol?
The canonical SMILES for 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol is CCC(CC)N(C)CC1(O)CCNCC1.
What is the InChIKey of 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol?
The InChIKey is HEPXYZORUGKZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-11(5-2)14(3)10-12(15)6-8-13-9-7-12/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol?
4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol has a molecular weight of 214.35 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol is sourced from PubChem (CID 62221672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).