4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one

C19H29N5O2 — CID 57447081

IUPAC4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one
SMILESCCCc1nc2c(N)nc(C)c(C)c2n1CCCC(=O)N1CCOCC1
InChIInChI=1S/C19H29N5O2/c1-4-6-15-22-17-18(13(2)14(3)21-19(17)20)24(15)8-5-7-16(25)23-9-11-26-12-10-23/h4-12H2,1-3H3,(H2,20,21)
InChIKeyFSJFMGGBFCKJBD-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.22
Rot. Bonds6

About 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one

4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one (PubChem CID 57447081) has the molecular formula C19H29N5O2 and a molecular weight of 359.47 g/mol. Its IUPAC name is 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one
PubChem CID57447081
Molecular FormulaC19H29N5O2
Molecular Weight359.47 g/mol
Exact Mass359.23
IUPAC Name4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one
SMILESCCCc1nc2c(N)nc(C)c(C)c2n1CCCC(=O)N1CCOCC1
InChIInChI=1S/C19H29N5O2/c1-4-6-15-22-17-18(13(2)14(3)21-19(17)20)24(15)8-5-7-16(25)23-9-11-26-12-10-23/h4-12H2,1-3H3,(H2,20,21)
InChIKeyFSJFMGGBFCKJBD-UHFFFAOYSA-N
XLogP2.22
TPSA86.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one?
The IUPAC name of 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one (CID 57447081) is 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one is CCCc1nc2c(N)nc(C)c(C)c2n1CCCC(=O)N1CCOCC1.
What is the InChIKey of 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one?
The InChIKey is FSJFMGGBFCKJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O2/c1-4-6-15-22-17-18(13(2)14(3)21-19(17)20)24(15)8-5-7-16(25)23-9-11-26-12-10-23/h4-12H2,1-3H3,(H2,20,21).
What are the key properties of 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one?
4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one has a molecular weight of 359.47 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-6,7-dimethyl-2-propylimidazo[4,5-c]pyridin-1-yl)-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 57447081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).