[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

C20H23N5O — CID 127246847

IUPAC[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCc1ccc2nc(C(=O)N3CCCC3c3ccnc(N(C)C)c3)cn2c1
InChIInChI=1S/C20H23N5O/c1-14-6-7-18-22-16(13-24(18)12-14)20(26)25-10-4-5-17(25)15-8-9-21-19(11-15)23(2)3/h6-9,11-13,17H,4-5,10H2,1-3H3
InChIKeyXZAVDVUMTIZKHN-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.08
Rot. Bonds3

About [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 127246847) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID127246847
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCc1ccc2nc(C(=O)N3CCCC3c3ccnc(N(C)C)c3)cn2c1
InChIInChI=1S/C20H23N5O/c1-14-6-7-18-22-16(13-24(18)12-14)20(26)25-10-4-5-17(25)15-8-9-21-19(11-15)23(2)3/h6-9,11-13,17H,4-5,10H2,1-3H3
InChIKeyXZAVDVUMTIZKHN-UHFFFAOYSA-N
XLogP3.08
TPSA53.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(2R)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-quinolin-2-ylmethanone
CID 125001075
(5-cyclopropyl-1,2-oxazol-3-yl)-[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]methanone
CID 175652507
3-[(2S)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidine-1-carbonyl]-6-methyl-1H-pyridin-2-one
CID 124973567
6-[(2R)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 125014374
2H-benzotriazol-5-yl-[(2S)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]methanone
CID 124994429
(6-chloroimidazo[1,2-a]pyridin-2-yl)-[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 46974535
2-[2-[(2S)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-2-oxoethyl]-6-methylpyridazin-3-one
CID 124997560
(7-methylimidazo[1,2-a]pyridin-2-yl)-[(2S)-2-pyridin-4-ylazepan-1-yl]methanone
CID 94249778
1-[(2S)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanone
CID 124984928
[(2R)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(1-methylsulfonylazetidin-3-yl)methanone
CID 124999262
1-[(2R)-2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-2-phenoxyethanone
CID 124980402
[6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-[2-(3,4-difluoro-5-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 166313993

Frequently Asked Questions

What is the IUPAC name of [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 127246847) is [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is Cc1ccc2nc(C(=O)N3CCCC3c3ccnc(N(C)C)c3)cn2c1.
What is the InChIKey of [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is XZAVDVUMTIZKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-14-6-7-18-22-16(13-24(18)12-14)20(26)25-10-4-5-17(25)15-8-9-21-19(11-15)23(2)3/h6-9,11-13,17H,4-5,10H2,1-3H3.
What are the key properties of [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 349.44 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(dimethylamino)-4-pyridinyl]pyrrolidin-1-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 127246847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).