4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine

C21H25N5O — CID 123807409

IUPAC4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine
SMILESc1cc2[nH]c(CN3CCOCC3)cc2c(-c2ccc(N3CCNC3)cc2)n1
InChIInChI=1S/C21H25N5O/c1-3-18(26-8-7-22-15-26)4-2-16(1)21-19-13-17(24-20(19)5-6-23-21)14-25-9-11-27-12-10-25/h1-6,13,22,24H,7-12,14-15H2
InChIKeyOGQGFFHGXPBXPG-UHFFFAOYSA-N
MW363.47 g/mol
LogP2.43
Rot. Bonds4

About 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine

4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine (PubChem CID 123807409) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine
PubChem CID123807409
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC Name4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine
SMILESc1cc2[nH]c(CN3CCOCC3)cc2c(-c2ccc(N3CCNC3)cc2)n1
InChIInChI=1S/C21H25N5O/c1-3-18(26-8-7-22-15-26)4-2-16(1)21-19-13-17(24-20(19)5-6-23-21)14-25-9-11-27-12-10-25/h1-6,13,22,24H,7-12,14-15H2
InChIKeyOGQGFFHGXPBXPG-UHFFFAOYSA-N
XLogP2.43
TPSA56.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine with MolForge

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Related Compounds

ethyl 1-[4-[2-(morpholin-4-ylmethyl)-1H-pyrrolo[3,2-c]pyridin-4-yl]phenyl]piperidine-4-carboxylate
CID 118152930
4-[[4-[4-(4-ethylpiperazin-1-yl)phenyl]-6-methyl-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine
CID 118152604
methyl-[4-[5-[2-(morpholin-4-ylmethyl)-1H-pyrrolo[3,2-c]pyridin-4-yl]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]borinic acid
CID 140763721
4-[(4-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl)methyl]morpholine
CID 138491339
4-[1-[4-[4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[3,2-c]pyridin-2-yl]cyclopropyl]morpholine
CID 118152811
4-[[1-(3-piperazin-1-ylphenyl)-5H-cyclopenta[c]pyridin-6-yl]methyl]morpholine
CID 149303077
5-[2-[4-(2-hydroxypropan-2-yl)phenyl]-1H-pyrrolo[3,2-c]pyridin-4-yl]-2-(morpholin-4-ylmethyl)benzonitrile
CID 158814530
4-[[1-[4-(4-methylpiperazin-1-yl)phenyl]-5H-cyclopenta[c]pyridin-6-yl]methyl]morpholine
CID 159056435
4-[(4-chloro-6-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]morpholine
CID 144861420
4-[4-(4-chlorophenyl)-3-(piperazin-1-ylmethyl)phenyl]morpholine
CID 67227304
4-[4-[6-(morpholin-4-ylmethyl)-5H-cyclopenta[c]pyridin-1-yl]phenyl]-1,4-thiazinane 1,1-dioxide
CID 149356736
4-[(4-chloro-2-pyridinyl)methyl]morpholine
CID 22025268

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine?
The IUPAC name of 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine (CID 123807409) is 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine is c1cc2[nH]c(CN3CCOCC3)cc2c(-c2ccc(N3CCNC3)cc2)n1.
What is the InChIKey of 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine?
The InChIKey is OGQGFFHGXPBXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-3-18(26-8-7-22-15-26)4-2-16(1)21-19-13-17(24-20(19)5-6-23-21)14-25-9-11-27-12-10-25/h1-6,13,22,24H,7-12,14-15H2.
What are the key properties of 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine?
4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine has a molecular weight of 363.47 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(4-imidazolidin-1-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl]morpholine is sourced from PubChem (CID 123807409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).