6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine

C19H22N6O — CID 112857696

IUPAC6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine
SMILESc1cnc2c(Nc3cc(NCCN4CCOCC4)ncn3)cccc2c1
InChIInChI=1S/C19H22N6O/c1-3-15-4-2-6-21-19(15)16(5-1)24-18-13-17(22-14-23-18)20-7-8-25-9-11-26-12-10-25/h1-6,13-14H,7-12H2,(H2,20,22,23,24)
InChIKeyIHOJQGXBEVUXTN-UHFFFAOYSA-N
MW350.43 g/mol
LogP2.51
Rot. Bonds6

About 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine

6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine (PubChem CID 112857696) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine
PubChem CID112857696
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine
SMILESc1cnc2c(Nc3cc(NCCN4CCOCC4)ncn3)cccc2c1
InChIInChI=1S/C19H22N6O/c1-3-15-4-2-6-21-19(15)16(5-1)24-18-13-17(22-14-23-18)20-7-8-25-9-11-26-12-10-25/h1-6,13-14H,7-12H2,(H2,20,22,23,24)
InChIKeyIHOJQGXBEVUXTN-UHFFFAOYSA-N
XLogP2.51
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144827
2-[[6-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]amino]benzonitrile
CID 112857711
4-N-(2,4-difluorophenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857698
6-N-(4-pyrrolidin-1-ylphenyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine
CID 112866920
4-N-(4-bromo-2-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857691
4-N-(2-ethyl-6-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857635
4-N-(3,4-difluorophenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857717
4-N-(2-methylquinolin-8-yl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,5,6-triamine
CID 19144965
6-methyl-2-(2-morpholin-4-ylethylamino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109325286
3-bromo-N-(2-morpholin-4-ylethyl)quinolin-8-amine
CID 116784312
6-N-[(4-methylphenyl)methyl]-4-N-quinolin-8-ylpyrimidine-4,6-diamine
CID 112859264
6-N-[(3-methylphenyl)methyl]-4-N-quinolin-8-ylpyrimidine-4,6-diamine
CID 112859132

Frequently Asked Questions

What is the IUPAC name of 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine (CID 112857696) is 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine is c1cnc2c(Nc3cc(NCCN4CCOCC4)ncn3)cccc2c1.
What is the InChIKey of 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine?
The InChIKey is IHOJQGXBEVUXTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-3-15-4-2-6-21-19(15)16(5-1)24-18-13-17(22-14-23-18)20-7-8-25-9-11-26-12-10-25/h1-6,13-14H,7-12H2,(H2,20,22,23,24).
What are the key properties of 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine?
6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine has a molecular weight of 350.43 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2-morpholin-4-ylethyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 112857696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).