7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine

C24H26ClN5O2 — CID 68632614

IUPAC7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine
SMILESCc1cccc(Cl)c1CCOc1c(N)ncc2c(-c3cn[nH]c3C3CCNCC3)coc12
InChIInChI=1S/C24H26ClN5O2/c1-14-3-2-4-20(25)16(14)7-10-31-23-22-18(11-28-24(23)26)19(13-32-22)17-12-29-30-21(17)15-5-8-27-9-6-15/h2-4,11-13,15,27H,5-10H2,1H3,(H2,26,28)(H,29,30)
InChIKeyBEYSJDBJYVCHGZ-UHFFFAOYSA-N
MW451.96 g/mol
LogP4.85
Rot. Bonds6

About 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine

7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine (PubChem CID 68632614) has the molecular formula C24H26ClN5O2 and a molecular weight of 451.96 g/mol. Its IUPAC name is 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine.

Molecular Properties

Compound Name7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine
PubChem CID68632614
Molecular FormulaC24H26ClN5O2
Molecular Weight451.96 g/mol
Exact Mass451.18
IUPAC Name7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine
SMILESCc1cccc(Cl)c1CCOc1c(N)ncc2c(-c3cn[nH]c3C3CCNCC3)coc12
InChIInChI=1S/C24H26ClN5O2/c1-14-3-2-4-20(25)16(14)7-10-31-23-22-18(11-28-24(23)26)19(13-32-22)17-12-29-30-21(17)15-5-8-27-9-6-15/h2-4,11-13,15,27H,5-10H2,1H3,(H2,26,28)(H,29,30)
InChIKeyBEYSJDBJYVCHGZ-UHFFFAOYSA-N
XLogP4.85
TPSA101.99 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.96
LogP ≤ 54.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

7-[2-(2,4-dimethyl-3-pyridinyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine
CID 68633389
3-(8-chloroisoquinolin-3-yl)-5-(5-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine
CID 68785884
3-[3-(aminomethyl)phenyl]-7-[2-(2,6-dichloro-3-fluorophenyl)ethoxy]furo[3,2-c]pyridin-6-amine
CID 90942213
7-[2-(2,6-dichloro-3,5-difluorophenyl)ethoxy]-3-(6-piperazin-1-yl-3-pyridinyl)furo[3,2-c]pyridin-6-amine
CID 87386039
4-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidine
CID 115053603
3-(8-chloro-6-fluoroisoquinolin-3-yl)-5-(5-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine
CID 68788419
3-(6,8-dichloroisoquinolin-3-yl)-5-(5-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine;trihydrochloride
CID 68785983
5-[6-amino-7-[2-(2,6-dichloro-3-fluorophenyl)ethoxy]furo[3,2-c]pyridin-3-yl]thiophene-3-carboxylic acid
CID 68633477
3-[[4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methyl]pyridin-2-amine
CID 70736621
3-(6-bromoisoquinolin-3-yl)-5-(5-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine;trihydrochloride
CID 68785910
N-[2-(2,6-dichlorophenoxy)ethyl]-N-methylpiperidin-4-amine
CID 43607211
4-(3-chlorophenyl)-5-cyclopropyl-1H-pyrazole
CID 126673050

Frequently Asked Questions

What is the IUPAC name of 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine?
The IUPAC name of 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine (CID 68632614) is 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine.
What is the SMILES notation for 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine?
The canonical SMILES for 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine is Cc1cccc(Cl)c1CCOc1c(N)ncc2c(-c3cn[nH]c3C3CCNCC3)coc12.
What is the InChIKey of 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine?
The InChIKey is BEYSJDBJYVCHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClN5O2/c1-14-3-2-4-20(25)16(14)7-10-31-23-22-18(11-28-24(23)26)19(13-32-22)17-12-29-30-21(17)15-5-8-27-9-6-15/h2-4,11-13,15,27H,5-10H2,1H3,(H2,26,28)(H,29,30).
What are the key properties of 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine?
7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine has a molecular weight of 451.96 g/mol, XLogP of 4.85, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(2-chloro-6-methylphenyl)ethoxy]-3-(5-piperidin-4-yl-1H-pyrazol-4-yl)furo[3,2-c]pyridin-6-amine is sourced from PubChem (CID 68632614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).