N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide

C13H21N5OS — CID 1383738

IUPACN-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide
SMILESO=C(CSc1nnnn1C1CCCC1)NC1CCCC1
InChIInChI=1S/C13H21N5OS/c19-12(14-10-5-1-2-6-10)9-20-13-15-16-17-18(13)11-7-3-4-8-11/h10-11H,1-9H2,(H,14,19)
InChIKeyQPGTXCXYWCPYDU-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.94
Rot. Bonds5

About N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide

N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide (PubChem CID 1383738) has the molecular formula C13H21N5OS and a molecular weight of 295.41 g/mol. Its IUPAC name is N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide
PubChem CID1383738
Molecular FormulaC13H21N5OS
Molecular Weight295.41 g/mol
Exact Mass295.15
IUPAC NameN-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide
SMILESO=C(CSc1nnnn1C1CCCC1)NC1CCCC1
InChIInChI=1S/C13H21N5OS/c19-12(14-10-5-1-2-6-10)9-20-13-15-16-17-18(13)11-7-3-4-8-11/h10-11H,1-9H2,(H,14,19)
InChIKeyQPGTXCXYWCPYDU-UHFFFAOYSA-N
XLogP1.94
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclohexyl-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide
CID 51244959
2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(3,5-dimethylpyrazolidin-4-yl)acetamide
CID 52973004
N-cyclopentyl-2-(1-ethyltetrazol-5-yl)sulfanylacetamide
CID 1452223
2-(1-tert-butyltetrazol-5-yl)sulfanyl-N-cyclooctylacetamide
CID 27045923
2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-cyclopropylethanone
CID 63902701
N-(1-benzylpiperidin-4-yl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide
CID 9204401
N-cyano-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide
CID 79194698
N-(1-adamantylmethyl)-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide
CID 27094172
N-cyclohexyl-4-[1-(4-methoxycyclohexyl)tetrazol-5-yl]sulfanylbutanamide
CID 21295423
2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-methoxyacetamide
CID 30907405
N-carbamoyl-3-(1-cyclohexyltetrazol-5-yl)sulfanylpropanamide
CID 47134608
N-(2-chloroprop-2-enyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide
CID 115636705

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide?
The IUPAC name of N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide (CID 1383738) is N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide.
What is the SMILES notation for N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide?
The canonical SMILES for N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide is O=C(CSc1nnnn1C1CCCC1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide?
The InChIKey is QPGTXCXYWCPYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5OS/c19-12(14-10-5-1-2-6-10)9-20-13-15-16-17-18(13)11-7-3-4-8-11/h10-11H,1-9H2,(H,14,19).
What are the key properties of N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide?
N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide has a molecular weight of 295.41 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide is sourced from PubChem (CID 1383738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).