N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine

C10H18N4S — CID 82712959

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine
SMILESCN(C)C1(CNc2ncns2)CCCC1
InChIInChI=1S/C10H18N4S/c1-14(2)10(5-3-4-6-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyBYVDDMHHJQYSQF-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.82
Rot. Bonds4

About N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine

N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine (PubChem CID 82712959) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine
PubChem CID82712959
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine
SMILESCN(C)C1(CNc2ncns2)CCCC1
InChIInChI=1S/C10H18N4S/c1-14(2)10(5-3-4-6-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13)
InChIKeyBYVDDMHHJQYSQF-UHFFFAOYSA-N
XLogP1.82
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclohexan-1-ol
CID 65274526
N-[[1-(aminomethyl)cyclohexyl]methyl]-1,2,4-thiadiazol-5-amine
CID 103970418
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 107164406
3-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrazin-2-amine
CID 83112048
N-[[1-(dimethylamino)cyclopentyl]methyl]-6-methylsulfanylpyrimidin-4-amine
CID 106972972
6-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]-5-methylpyrimidin-4-amine
CID 83113894
5-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,2-thiazole-3,5-diamine
CID 103365933
N-[[1-(dimethylamino)cyclopentyl]methyl]-5-fluoropyridin-2-amine
CID 83113071
2-[2-[[1-(dimethylamino)cyclobutyl]methylamino]-1,3-thiazol-4-yl]acetic acid
CID 105420721
N-[[1-(dimethylamino)cyclopentyl]methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 115328541
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-methylpyrimidin-2-amine
CID 78995555
4-chloro-6-[[1-(dimethylamino)cyclobutyl]methylamino]pyrimidine-5-carbaldehyde
CID 105419815

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine (CID 82712959) is N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine is CN(C)C1(CNc2ncns2)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is BYVDDMHHJQYSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-14(2)10(5-3-4-6-10)7-11-9-12-8-13-15-9/h8H,3-7H2,1-2H3,(H,11,12,13).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine?
N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 226.35 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 82712959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).