N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine

C16H17N3S — CID 60923008

IUPACN-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine
SMILESCN(Cc1ccc(CN)cc1)c1nccc2sccc12
InChIInChI=1S/C16H17N3S/c1-19(11-13-4-2-12(10-17)3-5-13)16-14-7-9-20-15(14)6-8-18-16/h2-9H,10-11,17H2,1H3
InChIKeyGKHRJOOBWNFBST-UHFFFAOYSA-N
MW283.40 g/mol
LogP3.39
Rot. Bonds4

About N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine

N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine (PubChem CID 60923008) has the molecular formula C16H17N3S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine
PubChem CID60923008
Molecular FormulaC16H17N3S
Molecular Weight283.40 g/mol
Exact Mass283.11
IUPAC NameN-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine
SMILESCN(Cc1ccc(CN)cc1)c1nccc2sccc12
InChIInChI=1S/C16H17N3S/c1-19(11-13-4-2-12(10-17)3-5-13)16-14-7-9-20-15(14)6-8-18-16/h2-9H,10-11,17H2,1H3
InChIKeyGKHRJOOBWNFBST-UHFFFAOYSA-N
XLogP3.39
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(aminomethyl)phenyl]-N-methylthieno[3,2-c]pyridin-4-amine
CID 62971692
N'-(2-methylpropyl)-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 62587629
4-[methyl(thieno[3,2-c]pyridin-4-yl)amino]butanoic acid
CID 43522697
thieno[3,2-c]pyridin-4-ylmethanamine
CID 82414810
N-(2-methoxyethyl)-N'-methyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 62586554
N-[[4-(aminomethyl)phenyl]methyl]-N,7-dimethylthieno[3,2-d]pyrimidin-4-amine
CID 102686089
4-(aminomethyl)-N-[(4-bromophenyl)methyl]-3-fluoro-N-methylpyridin-2-amine
CID 105389702
N'-phenyl-N'-thieno[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 60870418
2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol
CID 61425977
N-[[4-(aminomethyl)phenyl]methyl]-N,3,6-trimethylpyrazin-2-amine
CID 54939164
N-[[4-(aminomethyl)phenyl]methyl]-N-methyl-1,2,4-thiadiazol-5-amine
CID 65270237
N-[(3,4-dichlorophenyl)methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 9195393

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine (CID 60923008) is N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine is CN(Cc1ccc(CN)cc1)c1nccc2sccc12.
What is the InChIKey of N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine?
The InChIKey is GKHRJOOBWNFBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3S/c1-19(11-13-4-2-12(10-17)3-5-13)16-14-7-9-20-15(14)6-8-18-16/h2-9H,10-11,17H2,1H3.
What are the key properties of N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine?
N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine has a molecular weight of 283.40 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 60923008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).