N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide

C19H23N5O3 — CID 139005572

IUPACN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide
SMILESCOCc1ccc(C2CCCN2C(=O)Nc2cnc3c(c2)c(C)nn3C)o1
InChIInChI=1S/C19H23N5O3/c1-12-15-9-13(10-20-18(15)23(2)22-12)21-19(25)24-8-4-5-16(24)17-7-6-14(27-17)11-26-3/h6-7,9-10,16H,4-5,8,11H2,1-3H3,(H,21,25)
InChIKeyCOSRAMNRBBOUEO-UHFFFAOYSA-N
MW369.43 g/mol
LogP3.39
Rot. Bonds4

About N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide

N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide (PubChem CID 139005572) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide
PubChem CID139005572
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC NameN-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide
SMILESCOCc1ccc(C2CCCN2C(=O)Nc2cnc3c(c2)c(C)nn3C)o1
InChIInChI=1S/C19H23N5O3/c1-12-15-9-13(10-20-18(15)23(2)22-12)21-19(25)24-8-4-5-16(24)17-7-6-14(27-17)11-26-3/h6-7,9-10,16H,4-5,8,11H2,1-3H3,(H,21,25)
InChIKeyCOSRAMNRBBOUEO-UHFFFAOYSA-N
XLogP3.39
TPSA85.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-phenylazetidine-1-carboxamide
CID 94181192
5-[2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carbonyl]pyrazine-2-carboxylic acid
CID 120690417
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-phenylpyrrolidine-2-carboxamide
CID 139009521
4-[[2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 122023822
2-(dimethylamino)-1-[2-[5-(methoxymethyl)furan-2-yl]pyrrolidin-1-yl]ethanone
CID 86796200
(2R)-N-[[(2R)-1,4-diazabicyclo[2.2.2]octan-2-yl]methyl]-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide
CID 99637404
(2R)-N-[2-(3-hydroxyphenyl)ethyl]-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide
CID 99636971
(3-hydroxy-2-pyridinyl)-[2-[5-(methoxymethyl)furan-2-yl]pyrrolidin-1-yl]methanone
CID 91661571
[(2R)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidin-1-yl]-(1-propan-2-ylimidazol-4-yl)methanone
CID 124874162
[2-chloro-6-(methylamino)-4-pyridinyl]-[(2S)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidin-1-yl]methanone
CID 97309825
(2S)-N-[2-(dimethylamino)pyrimidin-5-yl]-2-(5-methylfuran-2-yl)piperidine-1-carboxamide
CID 99581240
[(2R)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidin-1-yl]-[(4S)-4,5,6,7-tetrahydro-1-benzothiophen-4-yl]methanone
CID 99715113

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide?
The IUPAC name of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide (CID 139005572) is N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide is COCc1ccc(C2CCCN2C(=O)Nc2cnc3c(c2)c(C)nn3C)o1.
What is the InChIKey of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide?
The InChIKey is COSRAMNRBBOUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-12-15-9-13(10-20-18(15)23(2)22-12)21-19(25)24-8-4-5-16(24)17-7-6-14(27-17)11-26-3/h6-7,9-10,16H,4-5,8,11H2,1-3H3,(H,21,25).
What are the key properties of N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide?
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-[5-(methoxymethyl)furan-2-yl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 139005572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).