1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol

C18H38N2O — CID 19026110

IUPAC1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol
SMILESCC(C)CCC(CCC(C)C)NCCN1CCC(O)CC1
InChIInChI=1S/C18H38N2O/c1-15(2)5-7-17(8-6-16(3)4)19-11-14-20-12-9-18(21)10-13-20/h15-19,21H,5-14H2,1-4H3
InChIKeyIREMOIWNYNABBM-UHFFFAOYSA-N
MW298.52 g/mol
LogP3.27
Rot. Bonds10

About 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol

1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol (PubChem CID 19026110) has the molecular formula C18H38N2O and a molecular weight of 298.52 g/mol. Its IUPAC name is 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol
PubChem CID19026110
Molecular FormulaC18H38N2O
Molecular Weight298.52 g/mol
Exact Mass298.30
IUPAC Name1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol
SMILESCC(C)CCC(CCC(C)C)NCCN1CCC(O)CC1
InChIInChI=1S/C18H38N2O/c1-15(2)5-7-17(8-6-16(3)4)19-11-14-20-12-9-18(21)10-13-20/h15-19,21H,5-14H2,1-4H3
InChIKeyIREMOIWNYNABBM-UHFFFAOYSA-N
XLogP3.27
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.52
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]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

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol?
The IUPAC name of 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol (CID 19026110) is 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol is CC(C)CCC(CCC(C)C)NCCN1CCC(O)CC1.
What is the InChIKey of 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol?
The InChIKey is IREMOIWNYNABBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2O/c1-15(2)5-7-17(8-6-16(3)4)19-11-14-20-12-9-18(21)10-13-20/h15-19,21H,5-14H2,1-4H3.
What are the key properties of 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol?
1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol has a molecular weight of 298.52 g/mol, XLogP of 3.27, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,8-dimethylnonan-5-ylamino)ethyl]piperidin-4-ol is sourced from PubChem (CID 19026110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).