N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide

C11H19N5OS — CID 4817666

IUPACN-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide
SMILESCC(Sc1nnnn1C)C(=O)NC1CCCCC1
InChIInChI=1S/C11H19N5OS/c1-8(18-11-13-14-15-16(11)2)10(17)12-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H,12,17)
InChIKeyIJSOVWXJMDKWGX-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.14
Rot. Bonds4

About N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide

N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide (PubChem CID 4817666) has the molecular formula C11H19N5OS and a molecular weight of 269.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide
PubChem CID4817666
Molecular FormulaC11H19N5OS
Molecular Weight269.37 g/mol
Exact Mass269.13
IUPAC NameN-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide
SMILESCC(Sc1nnnn1C)C(=O)NC1CCCCC1
InChIInChI=1S/C11H19N5OS/c1-8(18-11-13-14-15-16(11)2)10(17)12-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H,12,17)
InChIKeyIJSOVWXJMDKWGX-UHFFFAOYSA-N
XLogP1.14
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide 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-cyclopentyl-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 861211
2-(1-Butyl-1H-tetrazol-5-ylsulfanyl)-N-cyclohexyl-acetamide
CID 3212939
N-cyclopentyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide
CID 16339977
N-cyclohexyl-N-ethyl-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 2338857
N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 864617
N-cyclohexyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 855555
N-Cyclopentyl-2-(1-propyl-1H-tetrazol-5-ylsulfanyl)-acetamide
CID 1452242
N-Cyclopentyl-2-(1-isopropyl-1H-tetrazol-5-ylsulfanyl)-acetamide
CID 1452344
N-(2-methylcyclohexyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 3314638
N-(cyclohexylcarbamoyl)-2-(1-methyltetrazol-5-yl)sulfanylpropanamide
CID 4881534
N-(4-methylcyclohexyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 16305128
N-(2,3-dimethylcyclohexyl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
CID 2999200

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide?
The IUPAC name of N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide (CID 4817666) is N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide.
What is the SMILES notation for N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide?
The canonical SMILES for N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide is CC(Sc1nnnn1C)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide?
The InChIKey is IJSOVWXJMDKWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5OS/c1-8(18-11-13-14-15-16(11)2)10(17)12-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H,12,17).
What are the key properties of N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide?
N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide has a molecular weight of 269.37 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylpropanamide is sourced from PubChem (CID 4817666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).