N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

C21H24N6O2 — CID 176993743

IUPACN-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESC[C@@H](NC(=O)c1cc2cc(-n3cccn3)ncc2[nH]1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C21H24N6O2/c1-14(20(29)26-9-5-21(3-4-21)6-10-26)24-19(28)16-11-15-12-18(22-13-17(15)25-16)27-8-2-7-23-27/h2,7-8,11-14,25H,3-6,9-10H2,1H3,(H,24,28)/t14-/m1/s1
InChIKeyMQSGNPLACUACCL-CQSZACIVSA-N
MW392.46 g/mol
LogP2.27
Rot. Bonds4

About N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide (PubChem CID 176993743) has the molecular formula C21H24N6O2 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
PubChem CID176993743
Molecular FormulaC21H24N6O2
Molecular Weight392.46 g/mol
Exact Mass392.20
IUPAC NameN-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESC[C@@H](NC(=O)c1cc2cc(-n3cccn3)ncc2[nH]1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C21H24N6O2/c1-14(20(29)26-9-5-21(3-4-21)6-10-26)24-19(28)16-11-15-12-18(22-13-17(15)25-16)27-8-2-7-23-27/h2,7-8,11-14,25H,3-6,9-10H2,1H3,(H,24,28)/t14-/m1/s1
InChIKeyMQSGNPLACUACCL-CQSZACIVSA-N
XLogP2.27
TPSA95.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-(difluoromethyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 176994015
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-methyl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 176994031
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-chloro-5-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 176993755
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-7-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 176993825
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]isoquinoline-3-carboxamide
CID 171631464
5-amino-4-[(Z)-2-aminoprop-1-enyl]-N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-1H-pyrrole-2-carboxamide
CID 176993767
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-phenyl-1,3-oxazole-2-carboxamide
CID 174372863
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-chloroquinoline-3-carboxamide
CID 174373909
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-(4-cyanopyrazol-1-yl)pyridine-3-carboxamide
CID 171631581
5,6-dichloro-N-[(2R)-1-[(3R)-2,2-difluoro-5-azaspiro[2.4]heptan-5-yl]-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 176994011
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-2-[(1S,2S)-2-methylcyclopropyl]pyrimidine-5-carboxamide
CID 171631065
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-3-methyl-2-phenylimidazole-4-carboxamide
CID 171631253

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide (CID 176993743) is N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide is C[C@@H](NC(=O)c1cc2cc(-n3cccn3)ncc2[nH]1)C(=O)N1CCC2(CC1)CC2.
What is the InChIKey of N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The InChIKey is MQSGNPLACUACCL-CQSZACIVSA-N. The full InChI is InChI=1S/C21H24N6O2/c1-14(20(29)26-9-5-21(3-4-21)6-10-26)24-19(28)16-11-15-12-18(22-13-17(15)25-16)27-8-2-7-23-27/h2,7-8,11-14,25H,3-6,9-10H2,1H3,(H,24,28)/t14-/m1/s1.
What are the key properties of N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 176993743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).