2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide

C9H14N4OS — CID 64822320

IUPAC2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1nncs1
InChIInChI=1S/C9H14N4OS/c10-7-4-2-1-3-6(7)8(14)12-9-13-11-5-15-9/h5-7H,1-4,10H2,(H,12,13,14)
InChIKeyNFXIDMQUANMGKQ-UHFFFAOYSA-N
MW226.30 g/mol
LogP0.99
Rot. Bonds2

About 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide

2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide (PubChem CID 64822320) has the molecular formula C9H14N4OS and a molecular weight of 226.30 g/mol. Its IUPAC name is 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide
PubChem CID64822320
Molecular FormulaC9H14N4OS
Molecular Weight226.30 g/mol
Exact Mass226.09
IUPAC Name2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1nncs1
InChIInChI=1S/C9H14N4OS/c10-7-4-2-1-3-6(7)8(14)12-9-13-11-5-15-9/h5-7H,1-4,10H2,(H,12,13,14)
InChIKeyNFXIDMQUANMGKQ-UHFFFAOYSA-N
XLogP0.99
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-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

cis-(1S,2R)-2-(1,3,4-thiadiazol-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 868773
1-cycloheptyl-3-(1,3,4-thiadiazol-2-yl)urea
CID 47191642
(1S,6R)-3,4-dimethyl-6-(1,3,4-thiadiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 27474525
(1R,6S)-3,4-dimethyl-6-(1,3,4-thiadiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 27474537
N-(4-acetyl-1,3-thiazol-2-yl)-2-aminocyclopentane-1-carboxamide
CID 64852630
trans-(1R,2R)-2-amino-N-phenylcyclohexane-1-carboxamide
CID 10889384
(1R)-N-(1,3,4-thiadiazol-2-yl)cyclohex-3-ene-1-carboxamide
CID 29369502
(1S)-N-(1,3,4-thiadiazol-2-yl)cyclohex-3-ene-1-carboxamide
CID 29369503
2-amino-N-(4-methylphenyl)cyclohexane-1-carboxamide
CID 12512511
2-amino-N-(4-bromophenyl)cyclohexane-1-carboxamide
CID 64816780
cis-(1R,3S)-3-fluoro-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide
CID 129348789
2-amino-N-[4-(1,3-thiazol-2-yl)phenyl]cyclohexane-1-carboxamide
CID 64822199

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide (CID 64822320) is 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide is NC1CCCCC1C(=O)Nc1nncs1.
What is the InChIKey of 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide?
The InChIKey is NFXIDMQUANMGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS/c10-7-4-2-1-3-6(7)8(14)12-9-13-11-5-15-9/h5-7H,1-4,10H2,(H,12,13,14).
What are the key properties of 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide?
2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide has a molecular weight of 226.30 g/mol, XLogP of 0.99, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64822320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).