(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine

C10H21NS — CID 79680078

IUPAC(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine
SMILESCC(C)SC1(CN)CCCC1C
InChIInChI=1S/C10H21NS/c1-8(2)12-10(7-11)6-4-5-9(10)3/h8-9H,4-7,11H2,1-3H3
InChIKeyQIVDVCSGBKHABO-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.65
Rot. Bonds3

About (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine

(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine (PubChem CID 79680078) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine
PubChem CID79680078
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine
SMILESCC(C)SC1(CN)CCCC1C
InChIInChI=1S/C10H21NS/c1-8(2)12-10(7-11)6-4-5-9(10)3/h8-9H,4-7,11H2,1-3H3
InChIKeyQIVDVCSGBKHABO-UHFFFAOYSA-N
XLogP2.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methyl-1-(2-methylpropyl)cyclopentyl]methanamine
CID 83529449
(1-cyclopentylsulfanyl-2-methylcyclobutyl)methanamine
CID 66431153
1-(aminomethyl)-N-butan-2-yl-N,2-dimethylcyclopentan-1-amine
CID 65045613
1-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N,2-dimethylcyclopentan-1-amine
CID 65045048
1-(aminomethyl)-N,2-dimethyl-N-(3-methylbutyl)cyclopentan-1-amine
CID 65045881
2-methyl-1-(2-methyl-1-propylcyclohexyl)sulfanyl-1-propylcyclohexane
CID 141375882
1-(aminomethyl)-2-methyl-N-propan-2-ylcyclobutan-1-amine
CID 130554590
1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine
CID 65044842
1-(aminomethyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 65045214
cis-(1R,2S)-1-(aminomethyl)-2-methylcyclohexan-1-ol
CID 93046973
1-(aminomethyl)-2,7-dimethylcycloheptan-1-ol
CID 83905899
1-butyl-1-(1-butyl-2-methylcyclohexyl)sulfanyl-2-methylcyclohexane
CID 141375893

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine?
The IUPAC name of (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine (CID 79680078) is (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine.
What is the SMILES notation for (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine?
The canonical SMILES for (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine is CC(C)SC1(CN)CCCC1C.
What is the InChIKey of (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine?
The InChIKey is QIVDVCSGBKHABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-8(2)12-10(7-11)6-4-5-9(10)3/h8-9H,4-7,11H2,1-3H3.
What are the key properties of (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine?
(2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine has a molecular weight of 187.35 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1-propan-2-ylsulfanylcyclopentyl)methanamine is sourced from PubChem (CID 79680078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).