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

C19H23ClN4O3 — CID 176993755

IUPACN-[(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
SMILESCOc1ncc2[nH]c(C(=O)N[C@H](C)C(=O)N3CCC4(CC3)CC4)cc2c1Cl
InChIInChI=1S/C19H23ClN4O3/c1-11(18(26)24-7-5-19(3-4-19)6-8-24)22-16(25)13-9-12-14(23-13)10-21-17(27-2)15(12)20/h9-11,23H,3-8H2,1-2H3,(H,22,25)/t11-/m1/s1
InChIKeyVKTVTLNAYHQCLN-LLVKDONJSA-N
MW390.87 g/mol
LogP2.75
Rot. Bonds4

About 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

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 (PubChem CID 176993755) has the molecular formula C19H23ClN4O3 and a molecular weight of 390.87 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-[(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
PubChem CID176993755
Molecular FormulaC19H23ClN4O3
Molecular Weight390.87 g/mol
Exact Mass390.15
IUPAC NameN-[(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
SMILESCOc1ncc2[nH]c(C(=O)N[C@H](C)C(=O)N3CCC4(CC3)CC4)cc2c1Cl
InChIInChI=1S/C19H23ClN4O3/c1-11(18(26)24-7-5-19(3-4-19)6-8-24)22-16(25)13-9-12-14(23-13)10-21-17(27-2)15(12)20/h9-11,23H,3-8H2,1-2H3,(H,22,25)/t11-/m1/s1
InChIKeyVKTVTLNAYHQCLN-LLVKDONJSA-N
XLogP2.75
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.87
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 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 with MolForge

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Related Compounds

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-[(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]-5-pyrazol-1-yl-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 176993743
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-chloroquinoline-3-carboxamide
CID 174373909
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-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]isoquinoline-3-carboxamide
CID 171631464
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide
CID 171631062
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-2-[(1S,2S)-2-methylcyclopropyl]pyrimidine-5-carboxamide
CID 171631065
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
4-chloro-N-[(2S)-1-[[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-5-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 166749625
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]-4-chloro-5-methoxy-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]-4-chloro-5-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxamide (CID 176993755) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is COc1ncc2[nH]c(C(=O)N[C@H](C)C(=O)N3CCC4(CC3)CC4)cc2c1Cl.
What is the InChIKey of 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?
The InChIKey is VKTVTLNAYHQCLN-LLVKDONJSA-N. The full InChI is InChI=1S/C19H23ClN4O3/c1-11(18(26)24-7-5-19(3-4-19)6-8-24)22-16(25)13-9-12-14(23-13)10-21-17(27-2)15(12)20/h9-11,23H,3-8H2,1-2H3,(H,22,25)/t11-/m1/s1.
What are the key properties of 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?
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 has a molecular weight of 390.87 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 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]-4-chloro-5-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 176993755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).