N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide

C11H20N2O2S — CID 82908673

IUPACN-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide
SMILESO=C(NC1(CO)CCCC1)C1CSCCN1
InChIInChI=1S/C11H20N2O2S/c14-8-11(3-1-2-4-11)13-10(15)9-7-16-6-5-12-9/h9,12,14H,1-8H2,(H,13,15)
InChIKeyCKKACLIZXQKRST-UHFFFAOYSA-N
MW244.36 g/mol
LogP0.11
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide

N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide (PubChem CID 82908673) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide
PubChem CID82908673
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide
SMILESO=C(NC1(CO)CCCC1)C1CSCCN1
InChIInChI=1S/C11H20N2O2S/c14-8-11(3-1-2-4-11)13-10(15)9-7-16-6-5-12-9/h9,12,14H,1-8H2,(H,13,15)
InChIKeyCKKACLIZXQKRST-UHFFFAOYSA-N
XLogP0.11
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-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

2-[1-(thiomorpholine-3-carbonylamino)cyclopentyl]acetic acid
CID 82917741
N-[1-(hydroxymethyl)-4-methylcyclohexyl]thiomorpholine-3-carboxamide
CID 82908761
N-[[1-(hydroxymethyl)cyclohexyl]methyl]thiomorpholine-3-carboxamide
CID 113359665
N-[1-(hydroxymethyl)cyclohexyl]-2-thiomorpholin-3-ylacetamide
CID 66422291
1-[(thiomorpholine-3-carbonylamino)methyl]cycloheptane-1-carboxylic acid
CID 82918104
N-[(1-ethylcyclopentyl)methyl]thiomorpholine-3-carboxamide
CID 114125067
thiomorpholine-3-carbohydrazide
CID 14045872
(3S)-N-[1-(hydroxymethyl)cyclohexyl]-6,6-dimethyl-5-oxothiomorpholine-3-carboxamide
CID 125446392
2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid
CID 104914061
4-[(thiomorpholine-3-carbonylamino)methyl]oxane-4-carboxylic acid
CID 82917777
N-(2-aminoethyl)thiomorpholine-3-carboxamide
CID 82908482
N-[1-(hydroxymethyl)cyclohexyl]pyrrolidine-3-carboxamide
CID 63006732

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide (CID 82908673) is N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide is O=C(NC1(CO)CCCC1)C1CSCCN1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide?
The InChIKey is CKKACLIZXQKRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c14-8-11(3-1-2-4-11)13-10(15)9-7-16-6-5-12-9/h9,12,14H,1-8H2,(H,13,15).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide?
N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide has a molecular weight of 244.36 g/mol, XLogP of 0.11, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide is sourced from PubChem (CID 82908673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).