5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine

C14H18ClN3S — CID 79486505

IUPAC5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
SMILESCC(Cc1cccs1)N(C)Cc1nc(N)ccc1Cl
InChIInChI=1S/C14H18ClN3S/c1-10(8-11-4-3-7-19-11)18(2)9-13-12(15)5-6-14(16)17-13/h3-7,10H,8-9H2,1-2H3,(H2,16,17)
InChIKeyKUDKKQDORDLEFO-UHFFFAOYSA-N
MW295.84 g/mol
LogP3.44
Rot. Bonds5

About 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine

5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine (PubChem CID 79486505) has the molecular formula C14H18ClN3S and a molecular weight of 295.84 g/mol. Its IUPAC name is 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
PubChem CID79486505
Molecular FormulaC14H18ClN3S
Molecular Weight295.84 g/mol
Exact Mass295.09
IUPAC Name5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
SMILESCC(Cc1cccs1)N(C)Cc1nc(N)ccc1Cl
InChIInChI=1S/C14H18ClN3S/c1-10(8-11-4-3-7-19-11)18(2)9-13-12(15)5-6-14(16)17-13/h3-7,10H,8-9H2,1-2H3,(H2,16,17)
InChIKeyKUDKKQDORDLEFO-UHFFFAOYSA-N
XLogP3.44
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.84
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-[[methyl(4-methylpentan-2-yl)amino]methyl]pyridin-2-amine
CID 55127544
6-methyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyrimidin-4-amine
CID 80657795
5-chloro-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]aniline
CID 79476388
N-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-N-methyl-1-thiophen-2-ylpropan-2-amine
CID 79476509
5-chloro-6-[(dimethylamino)methyl]pyridin-2-amine
CID 62893036
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79470909
1-[2-[methyl(1-thiophen-2-ylpropan-2-yl)amino]ethyl]pyrazol-3-amine
CID 79471004
N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)pentane-1,5-diamine
CID 79476552
5-chloro-6-[[methyl(2-methylbutyl)amino]methyl]pyridin-2-amine
CID 62890774
1-[methyl(1-thiophen-2-ylpropan-2-yl)amino]propan-2-ol
CID 79485730
N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]-1-thiophen-2-ylpropan-2-amine
CID 106906849
6-methoxy-5-[[methyl-[(2S)-1-thiophen-2-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
CID 97160152

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine (CID 79486505) is 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine is CC(Cc1cccs1)N(C)Cc1nc(N)ccc1Cl.
What is the InChIKey of 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine?
The InChIKey is KUDKKQDORDLEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3S/c1-10(8-11-4-3-7-19-11)18(2)9-13-12(15)5-6-14(16)17-13/h3-7,10H,8-9H2,1-2H3,(H2,16,17).
What are the key properties of 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine?
5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine has a molecular weight of 295.84 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 79486505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).