7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C17H19N5O2 — CID 69168398

IUPAC7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESNCC1CN(c2c(-c3ccccc3)cnc3[nH]c(=O)[nH]c23)CCO1
InChIInChI=1S/C17H19N5O2/c18-8-12-10-22(6-7-24-12)15-13(11-4-2-1-3-5-11)9-19-16-14(15)20-17(23)21-16/h1-5,9,12H,6-8,10,18H2,(H2,19,20,21,23)
InChIKeyCPRKQSLNWMPWNE-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.08
Rot. Bonds3

About 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 69168398) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID69168398
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC Name7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESNCC1CN(c2c(-c3ccccc3)cnc3[nH]c(=O)[nH]c23)CCO1
InChIInChI=1S/C17H19N5O2/c18-8-12-10-22(6-7-24-12)15-13(11-4-2-1-3-5-11)9-19-16-14(15)20-17(23)21-16/h1-5,9,12H,6-8,10,18H2,(H2,19,20,21,23)
InChIKeyCPRKQSLNWMPWNE-UHFFFAOYSA-N
XLogP1.08
TPSA100.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[5-(2-chlorophenyl)-1H-pyrazolo[3,4-b]pyridin-4-yl]morpholin-2-yl]methanamine
CID 71091692
[4-[5-[4-(hydroxy-methyl-morpholin-4-yl-oxo-λ6-sulfanyl)phenyl]-1H-pyrazolo[3,4-b]pyridin-4-yl]morpholin-2-yl]methanamine
CID 143698255
5-[4-[2-(aminomethyl)morpholin-4-yl]-5,6-difluoro-8-(methylamino)-9H-pyrido[2,3-b]indol-3-yl]pyridine-3-carbonitrile
CID 146641858
[4-[5-(5-chlorothiophen-2-yl)-1H-pyrazolo[3,4-b]pyridin-4-yl]morpholin-2-yl]methanamine
CID 71091776
[4-(2-phenyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-yl)morpholin-2-yl]methanamine
CID 56896849
[4-(4-methylphthalazin-1-yl)morpholin-2-yl]methanamine
CID 61337016
[4-(1,3-benzoxazol-2-yl)morpholin-2-yl]methanamine
CID 61338953
[4-[5-(1H-pyrrol-3-yl)pyrimidin-2-yl]morpholin-2-yl]methanamine
CID 116976332
(2S)-2-(2-fluoroethyl)-4-(4-phenyl-1,3,5-triazin-2-yl)morpholine
CID 164637809
[4-(6-amino-2-phenylpyrimidin-4-yl)morpholin-2-yl]methanol
CID 115915735
3-[4-[2-(aminomethyl)morpholin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide;ethane
CID 143698276
7-[2-(aminomethyl)morpholin-4-yl]-2H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
CID 66282684

Frequently Asked Questions

What is the IUPAC name of 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 69168398) is 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is NCC1CN(c2c(-c3ccccc3)cnc3[nH]c(=O)[nH]c23)CCO1.
What is the InChIKey of 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is CPRKQSLNWMPWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c18-8-12-10-22(6-7-24-12)15-13(11-4-2-1-3-5-11)9-19-16-14(15)20-17(23)21-16/h1-5,9,12H,6-8,10,18H2,(H2,19,20,21,23).
What are the key properties of 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 325.37 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(aminomethyl)morpholin-4-yl]-6-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 69168398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).