N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide

C11H18N4OS — CID 65210136

IUPACN-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NC1(CN)CCCC1
InChIInChI=1S/C11H18N4OS/c1-2-8-9(17-15-14-8)10(16)13-11(7-12)5-3-4-6-11/h2-7,12H2,1H3,(H,13,16)
InChIKeyKVMAZVNLMILPCF-UHFFFAOYSA-N
MW254.36 g/mol
LogP1.10
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide

N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide (PubChem CID 65210136) has the molecular formula C11H18N4OS and a molecular weight of 254.36 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide
PubChem CID65210136
Molecular FormulaC11H18N4OS
Molecular Weight254.36 g/mol
Exact Mass254.12
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NC1(CN)CCCC1
InChIInChI=1S/C11H18N4OS/c1-2-8-9(17-15-14-8)10(16)13-11(7-12)5-3-4-6-11/h2-7,12H2,1H3,(H,13,16)
InChIKeyKVMAZVNLMILPCF-UHFFFAOYSA-N
XLogP1.10
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-N-[1-(hydroxymethyl)cyclobutyl]thiadiazole-5-carboxamide
CID 115878220
2-[1-[(4-ethylthiadiazole-5-carbonyl)amino]cyclobutyl]acetic acid
CID 79848305
4-ethyl-N-[1-(N'-hydroxycarbamimidoyl)cyclopentyl]thiadiazole-5-carboxamide
CID 77059715
1-[(4-ethylthiadiazole-5-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 81158582
2-[1-[(4-propylthiadiazole-5-carbonyl)amino]cyclobutyl]acetic acid
CID 79848854
N-[1-(chloromethyl)-4-methylcyclohexyl]-4-ethylthiadiazole-5-carboxamide
CID 113273214
N-[[1-(chloromethyl)cyclopropyl]methyl]-4-ethylthiadiazole-5-carboxamide
CID 115456007
1-[[(4-ethylthiadiazole-5-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 81361690
N-cyclopentyl-4-ethylthiadiazole-5-carboxamide
CID 51204913
N-[(2S)-1-aminopropan-2-yl]-4-ethylthiadiazole-5-carboxamide;hydrochloride
CID 120505502
4-ethylthiadiazole-5-carboxamide
CID 45084470
N-(1-cyanocycloheptyl)-4-propylthiadiazole-5-carboxamide
CID 65205161

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide (CID 65210136) is N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)NC1(CN)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide?
The InChIKey is KVMAZVNLMILPCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4OS/c1-2-8-9(17-15-14-8)10(16)13-11(7-12)5-3-4-6-11/h2-7,12H2,1H3,(H,13,16).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide?
N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide has a molecular weight of 254.36 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide is sourced from PubChem (CID 65210136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).