N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine

C19H22N4OS — CID 133408056

IUPACN,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(N(C)Cc3ccccc3N3CCOCC3)ncnc2s1
InChIInChI=1S/C19H22N4OS/c1-14-11-16-18(20-13-21-19(16)25-14)22(2)12-15-5-3-4-6-17(15)23-7-9-24-10-8-23/h3-6,11,13H,7-10,12H2,1-2H3
InChIKeyLQDSJQKGURGQCA-UHFFFAOYSA-N
MW354.48 g/mol
LogP3.47
Rot. Bonds4

About N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine

N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine (PubChem CID 133408056) has the molecular formula C19H22N4OS and a molecular weight of 354.48 g/mol. Its IUPAC name is N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
PubChem CID133408056
Molecular FormulaC19H22N4OS
Molecular Weight354.48 g/mol
Exact Mass354.15
IUPAC NameN,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(N(C)Cc3ccccc3N3CCOCC3)ncnc2s1
InChIInChI=1S/C19H22N4OS/c1-14-11-16-18(20-13-21-19(16)25-14)22(2)12-15-5-3-4-6-17(15)23-7-9-24-10-8-23/h3-6,11,13H,7-10,12H2,1-2H3
InChIKeyLQDSJQKGURGQCA-UHFFFAOYSA-N
XLogP3.47
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-4-N-methyl-4-N-[(2-morpholin-4-ylphenyl)methyl]pyrimidine-4,6-diamine
CID 122148704
1-(4-fluorophenyl)-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine
CID 25342698
2-[methyl-(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 133407503
6-methyl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 133407915
methyl 2,5-dimethyl-4-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate
CID 26447787
N'-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylethane-1,2-diamine
CID 63618416
N'-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propan-2-ylethane-1,2-diamine
CID 63617064
N-[(2,5-dimethyl-4-pyrrolidin-1-ylphenyl)methyl]-N-methyl-1-(2-morpholin-4-ylphenyl)methanamine
CID 92626603
2-[methyl-(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-(2-methylsulfanylphenyl)acetamide
CID 133408809
N,N-diethyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 2972044
4-[2-(2,2-dimethylpropyl)phenyl]morpholine
CID 58063137
4-[methyl-(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]oxolane-3-carboxylic acid
CID 66235368

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine (CID 133408056) is N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine is Cc1cc2c(N(C)Cc3ccccc3N3CCOCC3)ncnc2s1.
What is the InChIKey of N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is LQDSJQKGURGQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4OS/c1-14-11-16-18(20-13-21-19(16)25-14)22(2)12-15-5-3-4-6-17(15)23-7-9-24-10-8-23/h3-6,11,13H,7-10,12H2,1-2H3.
What are the key properties of N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine?
N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 354.48 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 133408056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).