N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide

C20H21N5O2 — CID 170425127

IUPACN-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide
SMILESCC(=O)Nc1cc2c(cn1)c(C1CC1)nn2-c1cccc([C@H]2CCOC2)n1
InChIInChI=1S/C20H21N5O2/c1-12(26)22-18-9-17-15(10-21-18)20(13-5-6-13)24-25(17)19-4-2-3-16(23-19)14-7-8-27-11-14/h2-4,9-10,13-14H,5-8,11H2,1H3,(H,21,22,26)/t14-/m0/s1
InChIKeyZQBCGYXAGSGRCX-AWEZNQCLSA-N
MW363.42 g/mol
LogP3.16
Rot. Bonds4

About N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide

N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide (PubChem CID 170425127) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide.

Molecular Properties

Compound NameN-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide
PubChem CID170425127
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC NameN-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide
SMILESCC(=O)Nc1cc2c(cn1)c(C1CC1)nn2-c1cccc([C@H]2CCOC2)n1
InChIInChI=1S/C20H21N5O2/c1-12(26)22-18-9-17-15(10-21-18)20(13-5-6-13)24-25(17)19-4-2-3-16(23-19)14-7-8-27-11-14/h2-4,9-10,13-14H,5-8,11H2,1H3,(H,21,22,26)/t14-/m0/s1
InChIKeyZQBCGYXAGSGRCX-AWEZNQCLSA-N
XLogP3.16
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?
The IUPAC name of N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide (CID 170425127) is N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide.
What is the SMILES notation for N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?
The canonical SMILES for N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide is CC(=O)Nc1cc2c(cn1)c(C1CC1)nn2-c1cccc([C@H]2CCOC2)n1.
What is the InChIKey of N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?
The InChIKey is ZQBCGYXAGSGRCX-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H21N5O2/c1-12(26)22-18-9-17-15(10-21-18)20(13-5-6-13)24-25(17)19-4-2-3-16(23-19)14-7-8-27-11-14/h2-4,9-10,13-14H,5-8,11H2,1H3,(H,21,22,26)/t14-/m0/s1.
What are the key properties of N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide?
N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide has a molecular weight of 363.42 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-cyclopropyl-1-[6-[(3R)-oxolan-3-yl]-2-pyridinyl]pyrazolo[4,3-c]pyridin-6-yl]acetamide is sourced from PubChem (CID 170425127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).