1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide

C20H24N4O2 — CID 97374981

IUPAC1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
SMILESCn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)c2ccccn2)CC3)c1
InChIInChI=1S/C20H24N4O2/c1-23-11-6-15(14-23)18(25)22-17-5-7-20(17)8-12-24(13-9-20)19(26)16-4-2-3-10-21-16/h2-4,6,10-11,14,17H,5,7-9,12-13H2,1H3,(H,22,25)/t17-/m1/s1
InChIKeyYNUJRLZTKTWESH-QGZVFWFLSA-N
MW352.44 g/mol
LogP2.23
Rot. Bonds3

About 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide

1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide (PubChem CID 97374981) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
PubChem CID97374981
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
SMILESCn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)c2ccccn2)CC3)c1
InChIInChI=1S/C20H24N4O2/c1-23-11-6-15(14-23)18(25)22-17-5-7-20(17)8-12-24(13-9-20)19(26)16-4-2-3-10-21-16/h2-4,6,10-11,14,17H,5,7-9,12-13H2,1H3,(H,22,25)/t17-/m1/s1
InChIKeyYNUJRLZTKTWESH-QGZVFWFLSA-N
XLogP2.23
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide with MolForge

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Related Compounds

1-methyl-N-[(3R)-7-(1-methylpyrrole-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
CID 97374971
1-methyl-N-[(3S)-7-(pyridin-2-ylmethyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
CID 97374960
1-methyl-N-[7-(pyridine-4-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide;2,2,2-trifluoroacetic acid
CID 118744218
1-methyl-N-[(3R)-7-[(5-methylthiophen-2-yl)methyl]-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide
CID 97374956
(4-methylphenyl)-[1-(pyridine-2-carbonyl)piperidin-4-yl]methanone
CID 141265347
N-[(3R)-7-(pyridin-2-ylmethyl)-7-azaspiro[3.5]nonan-3-yl]pyrazine-2-carboxamide
CID 97374758
1-methyl-1'-(pyridine-2-carbonyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375637
3-methoxy-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 47029925
1-[1-(pyridine-2-carbonyl)piperidin-4-yl]cyclopropane-1-carboxylic acid
CID 68604423
1-[4-[4-(pyridine-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]ethanone
CID 110814030
[4-(hydroxyamino)phenyl]-[4-(pyridine-2-carbonyl)piperazin-1-yl]methanone
CID 139375717
8-(pyridine-2-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 47138301

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide?
The IUPAC name of 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide (CID 97374981) is 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide.
What is the SMILES notation for 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide?
The canonical SMILES for 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide is Cn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)c2ccccn2)CC3)c1.
What is the InChIKey of 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide?
The InChIKey is YNUJRLZTKTWESH-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-23-11-6-15(14-23)18(25)22-17-5-7-20(17)8-12-24(13-9-20)19(26)16-4-2-3-10-21-16/h2-4,6,10-11,14,17H,5,7-9,12-13H2,1H3,(H,22,25)/t17-/m1/s1.
What are the key properties of 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide?
1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(3R)-7-(pyridine-2-carbonyl)-7-azaspiro[3.5]nonan-3-yl]pyrrole-3-carboxamide is sourced from PubChem (CID 97374981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).