N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide

C15H30N2O2 — CID 111619014

IUPACN-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide
SMILESCC(O)CC(C)(C)CNC(=O)N1CC(C)(C)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-11(18)8-13(2,3)9-16-12(19)17-10-14(4,5)15(17,6)7/h11,18H,8-10H2,1-7H3,(H,16,19)
InChIKeyXBZUJTRESZKBHN-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.61
Rot. Bonds4

About N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide

N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide (PubChem CID 111619014) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide
PubChem CID111619014
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide
SMILESCC(O)CC(C)(C)CNC(=O)N1CC(C)(C)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-11(18)8-13(2,3)9-16-12(19)17-10-14(4,5)15(17,6)7/h11,18H,8-10H2,1-7H3,(H,16,19)
InChIKeyXBZUJTRESZKBHN-UHFFFAOYSA-N
XLogP2.61
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide 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

N-(4-hydroxy-2,2-dimethylpentyl)thiomorpholine-4-carboxamide
CID 111507324
N-(4-hydroxy-2,2-dimethylpentyl)-4-methylpiperidine-1-carboxamide
CID 111507377
4-(2,2-difluoroethyl)-N-(4-hydroxy-2,2-dimethylpentyl)piperazine-1-carboxamide
CID 111507298
N-(4-hydroxy-2,2-dimethylpentyl)-3-methylpiperidine-1-carboxamide
CID 111507279
4-(cyclopropylmethyl)-N-(4-hydroxy-2,2-dimethylpentyl)piperazine-1-carboxamide
CID 111507440
(2R,6R)-N-[(4S)-4-hydroxy-2,2-dimethylpentyl]-2,6-dimethylazepane-1-carboxamide
CID 124865148
N-(4-hydroxy-2,2-dimethylpentyl)-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine-1-carboxamide
CID 111507564
N-(4-hydroxy-2,2-dimethylpentyl)-2-(2-methylpropyl)pyrrolidine-1-carboxamide
CID 111507392
N-(4-hydroxy-2,2-dimethylpentyl)-3-(methoxymethyl)piperidine-1-carboxamide
CID 111507311
1-(3-cyclopentylpropyl)-3-(4-hydroxy-2,2-dimethylpentyl)urea
CID 111479340
1-(4-hydroxy-2,2-dimethylpentyl)-3-(4-hydroxy-2-methylpentyl)urea
CID 111507544
N-(4-hydroxy-2,2-dimethylpentyl)-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 111507374

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide?
The IUPAC name of N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide (CID 111619014) is N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide.
What is the SMILES notation for N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide?
The canonical SMILES for N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide is CC(O)CC(C)(C)CNC(=O)N1CC(C)(C)C1(C)C.
What is the InChIKey of N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide?
The InChIKey is XBZUJTRESZKBHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-11(18)8-13(2,3)9-16-12(19)17-10-14(4,5)15(17,6)7/h11,18H,8-10H2,1-7H3,(H,16,19).
What are the key properties of N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide?
N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide has a molecular weight of 270.42 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2,2-dimethylpentyl)-2,2,3,3-tetramethylazetidine-1-carboxamide is sourced from PubChem (CID 111619014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).