N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine

C15H25N3S — CID 106907080

IUPACN-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
SMILESCSCC(C)N(C)Cc1cccc(CNC2CC2)n1
InChIInChI=1S/C15H25N3S/c1-12(11-19-3)18(2)10-15-6-4-5-14(17-15)9-16-13-7-8-13/h4-6,12-13,16H,7-11H2,1-3H3
InChIKeySAIQYQRJVVJJEV-UHFFFAOYSA-N
MW279.45 g/mol
LogP2.52
Rot. Bonds8

About N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine

N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine (PubChem CID 106907080) has the molecular formula C15H25N3S and a molecular weight of 279.45 g/mol. Its IUPAC name is N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
PubChem CID106907080
Molecular FormulaC15H25N3S
Molecular Weight279.45 g/mol
Exact Mass279.18
IUPAC NameN-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
SMILESCSCC(C)N(C)Cc1cccc(CNC2CC2)n1
InChIInChI=1S/C15H25N3S/c1-12(11-19-3)18(2)10-15-6-4-5-14(17-15)9-16-13-7-8-13/h4-6,12-13,16H,7-11H2,1-3H3
InChIKeySAIQYQRJVVJJEV-UHFFFAOYSA-N
XLogP2.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906060
N-[[6-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906024
N-methyl-1-methylsulfanyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]butan-2-amine
CID 106907072
N-[[6-[[3-methoxypropyl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906493
2-N-[6-[(cyclopropylamino)methyl]-2-pyridinyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191474
N-[[6-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906508
5-[(cyclopropylamino)methyl]-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrazin-2-amine
CID 107380594
6-[(cyclopropylamino)methyl]-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 62281585
6-[(cyclopropylamino)methyl]-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62284157
6-[(cyclopropylamino)methyl]-N-(2-methoxypropyl)pyridin-2-amine
CID 102700710
N-cyclopropyl-N'-methyl-N'-(1-methylsulfanylpropan-2-yl)ethane-1,2-diamine
CID 112661279
6-[(cyclopropylamino)methyl]-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
CID 79490139

Frequently Asked Questions

What is the IUPAC name of N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine (CID 106907080) is N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine is CSCC(C)N(C)Cc1cccc(CNC2CC2)n1.
What is the InChIKey of N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
The InChIKey is SAIQYQRJVVJJEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3S/c1-12(11-19-3)18(2)10-15-6-4-5-14(17-15)9-16-13-7-8-13/h4-6,12-13,16H,7-11H2,1-3H3.
What are the key properties of N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine?
N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine has a molecular weight of 279.45 g/mol, XLogP of 2.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 106907080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).