1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide

C14H27NO3 — CID 109381283

IUPAC1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide
SMILESCC(C)C(O)C(C)(C)CNC(=O)C1(O)CCCC1
InChIInChI=1S/C14H27NO3/c1-10(2)11(16)13(3,4)9-15-12(17)14(18)7-5-6-8-14/h10-11,16,18H,5-9H2,1-4H3,(H,15,17)
InChIKeyHNRPFSBDBYLLTJ-UHFFFAOYSA-N
MW257.37 g/mol
LogP1.45
Rot. Bonds5

About 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide

1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide (PubChem CID 109381283) has the molecular formula C14H27NO3 and a molecular weight of 257.37 g/mol. Its IUPAC name is 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide
PubChem CID109381283
Molecular FormulaC14H27NO3
Molecular Weight257.37 g/mol
Exact Mass257.20
IUPAC Name1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide
SMILESCC(C)C(O)C(C)(C)CNC(=O)C1(O)CCCC1
InChIInChI=1S/C14H27NO3/c1-10(2)11(16)13(3,4)9-15-12(17)14(18)7-5-6-8-14/h10-11,16,18H,5-9H2,1-4H3,(H,15,17)
InChIKeyHNRPFSBDBYLLTJ-UHFFFAOYSA-N
XLogP1.45
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.37
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-hydroxycyclohexyl)-N-(3-hydroxy-2,2,4-trimethylpentyl)acetamide
CID 109380808
N-(2,2-dimethylpropyl)-1-hydroxycyclobutane-1-carboxamide
CID 126988304
1-hydroxy-N-(2-hydroxypropyl)cyclopentane-1-carboxamide
CID 130676498
1-hydroxy-N-(2-methoxy-2-methylpropyl)cyclopentane-1-carboxamide
CID 111485529
1-(2-fluorophenyl)-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopropane-1-carboxamide
CID 109380998
N-ethyl-1-hydroxycyclopentane-1-carboxamide
CID 131085818
1-hydroxy-N-(2-methylpropyl)cyclobutane-1-carboxamide
CID 131043772
N'-(3-hydroxy-2,2,4-trimethylpentyl)-N-prop-2-ynylpropanediamide
CID 110017612
N-(3-hydroxy-2,2,4-trimethylpentyl)-2-[methyl(propan-2-yl)amino]acetamide
CID 109380805
N-(2,2-dimethyl-4-oxopentan-3-yl)-1-hydroxycyclopentane-1-carboxamide
CID 58331654
1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide
CID 111102357
N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-1-hydroxycyclopentane-1-carboxamide
CID 99702505

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide (CID 109381283) is 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide is CC(C)C(O)C(C)(C)CNC(=O)C1(O)CCCC1.
What is the InChIKey of 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide?
The InChIKey is HNRPFSBDBYLLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO3/c1-10(2)11(16)13(3,4)9-15-12(17)14(18)7-5-6-8-14/h10-11,16,18H,5-9H2,1-4H3,(H,15,17).
What are the key properties of 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide?
1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide has a molecular weight of 257.37 g/mol, XLogP of 1.45, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(3-hydroxy-2,2,4-trimethylpentyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 109381283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).