1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide

C10H18N6OS — CID 79586848

IUPAC1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide
SMILESCn1nnnc1SCCC1CCCC1(N)C(N)=O
InChIInChI=1S/C10H18N6OS/c1-16-9(13-14-15-16)18-6-4-7-3-2-5-10(7,12)8(11)17/h7H,2-6,12H2,1H3,(H2,11,17)
InChIKeyGQMBUAYNKLZGEI-UHFFFAOYSA-N
MW270.36 g/mol
LogP-0.32
Rot. Bonds5

About 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide

1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide (PubChem CID 79586848) has the molecular formula C10H18N6OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide
PubChem CID79586848
Molecular FormulaC10H18N6OS
Molecular Weight270.36 g/mol
Exact Mass270.13
IUPAC Name1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide
SMILESCn1nnnc1SCCC1CCCC1(N)C(N)=O
InChIInChI=1S/C10H18N6OS/c1-16-9(13-14-15-16)18-6-4-7-3-2-5-10(7,12)8(11)17/h7H,2-6,12H2,1H3,(H2,11,17)
InChIKeyGQMBUAYNKLZGEI-UHFFFAOYSA-N
XLogP-0.32
TPSA112.71 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]-1-(propylamino)cyclopentane-1-carbonitrile
CID 79578195
1-amino-2-[2-[(5-bromo-2-pyridinyl)sulfanyl]ethyl]cyclopentane-1-carboxamide
CID 79582299
1-cyclopentyl-2-(1-methyltetrazol-5-yl)sulfanylethanone
CID 115648631
1-amino-2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethyl]cyclopentane-1-carboxamide
CID 104968705
1-cyclohexyl-2-(1-methyltetrazol-5-yl)sulfanylethanone
CID 115576378
4-(1-methyltetrazol-5-yl)sulfanylbutan-2-one
CID 3613438
methyl 1-amino-2-[2-(2,5-dimethylpyrazol-3-yl)sulfanylethyl]cyclopentane-1-carboxylate
CID 79582997
1-amino-2-[2-(4,5-dimethylimidazol-1-yl)ethyl]cyclopentane-1-carboxamide
CID 79571495
1-amino-2-[2-(2-nitrophenyl)sulfanylethyl]cyclopentane-1-carboxamide
CID 79587386
1-amino-2-[2-(2,2-dimethylpyrrolidin-1-yl)ethyl]cyclopentane-1-carboxamide
CID 79563637
1-methyl-5-[(1-methyltetrazol-5-yl)sulfanylmethylsulfanyl]tetrazole
CID 1281683
2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79586712

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide (CID 79586848) is 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide is Cn1nnnc1SCCC1CCCC1(N)C(N)=O.
What is the InChIKey of 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide?
The InChIKey is GQMBUAYNKLZGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6OS/c1-16-9(13-14-15-16)18-6-4-7-3-2-5-10(7,12)8(11)17/h7H,2-6,12H2,1H3,(H2,11,17).
What are the key properties of 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide?
1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide has a molecular weight of 270.36 g/mol, XLogP of -0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[2-(1-methyltetrazol-5-yl)sulfanylethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 79586848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).