(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine

C10H16N2S — CID 130826140

IUPAC(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine
SMILESCc1cc(SC(C)C)c(CN)cn1
InChIInChI=1S/C10H16N2S/c1-7(2)13-10-4-8(3)12-6-9(10)5-11/h4,6-7H,5,11H2,1-3H3
InChIKeyLFJGIPUKFPXLIJ-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.35
Rot. Bonds3

About (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine

(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine (PubChem CID 130826140) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine
PubChem CID130826140
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine
SMILESCc1cc(SC(C)C)c(CN)cn1
InChIInChI=1S/C10H16N2S/c1-7(2)13-10-4-8(3)12-6-9(10)5-11/h4,6-7H,5,11H2,1-3H3
InChIKeyLFJGIPUKFPXLIJ-UHFFFAOYSA-N
XLogP2.35
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aminomethyl)-2-methyl-N,N-bis(3-methylbutyl)pyridin-4-amine
CID 107871241
(4-ethoxy-6-methyl-3-pyridinyl)methanamine
CID 81255491
(4-ethynyl-6-methyl-3-pyridinyl)methanamine
CID 74888678
[6-methyl-4-(5-methyl-2-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81250497
5-(aminomethyl)-N,2-dimethyl-N-(2-methylbutyl)pyridin-4-amine
CID 81248991
(6-methyl-4-phenyl-3-pyridinyl)methanamine
CID 90247119
5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine
CID 81246878
(5-fluoro-2-propan-2-ylsulfanylphenyl)methanamine
CID 63673498
[6-methyl-4-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanamine
CID 81250797
[4-(3,4-dimethylpyrrolidin-1-yl)-6-methyl-3-pyridinyl]methanamine
CID 81248079
(5-chloro-2-propan-2-ylsulfanylphenyl)methanamine;hydrochloride
CID 66878534
[4-(2,5-dibromo-4-methoxyphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 81251048

Frequently Asked Questions

What is the IUPAC name of (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine?
The IUPAC name of (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine (CID 130826140) is (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine.
What is the SMILES notation for (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine?
The canonical SMILES for (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine is Cc1cc(SC(C)C)c(CN)cn1.
What is the InChIKey of (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine?
The InChIKey is LFJGIPUKFPXLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-7(2)13-10-4-8(3)12-6-9(10)5-11/h4,6-7H,5,11H2,1-3H3.
What are the key properties of (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine?
(6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine has a molecular weight of 196.32 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-4-propan-2-ylsulfanyl-3-pyridinyl)methanamine is sourced from PubChem (CID 130826140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).