(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one

C20H27N5O2 — CID 97342768

IUPAC(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
SMILESCC(C)N1CCC[C@@H](N2CCN(C(=O)c3cn4ccccc4n3)CC2)C1=O
InChIInChI=1S/C20H27N5O2/c1-15(2)25-9-5-6-17(20(25)27)22-10-12-23(13-11-22)19(26)16-14-24-8-4-3-7-18(24)21-16/h3-4,7-8,14-15,17H,5-6,9-13H2,1-2H3/t17-/m1/s1
InChIKeyHWAIVUPTHHNEGG-QGZVFWFLSA-N
MW369.47 g/mol
LogP1.49
Rot. Bonds3

About (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one

(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one (PubChem CID 97342768) has the molecular formula C20H27N5O2 and a molecular weight of 369.47 g/mol. Its IUPAC name is (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one.

Molecular Properties

Compound Name(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
PubChem CID97342768
Molecular FormulaC20H27N5O2
Molecular Weight369.47 g/mol
Exact Mass369.22
IUPAC Name(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
SMILESCC(C)N1CCC[C@@H](N2CCN(C(=O)c3cn4ccccc4n3)CC2)C1=O
InChIInChI=1S/C20H27N5O2/c1-15(2)25-9-5-6-17(20(25)27)22-10-12-23(13-11-22)19(26)16-14-24-8-4-3-7-18(24)21-16/h3-4,7-8,14-15,17H,5-6,9-13H2,1-2H3/t17-/m1/s1
InChIKeyHWAIVUPTHHNEGG-QGZVFWFLSA-N
XLogP1.49
TPSA61.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one with MolForge

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Related Compounds

(3R)-3-[4-(2-methylsulfonylbenzoyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
CID 97342786
1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 43355877
3-[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
CID 75468323
(3R)-3-[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one
CID 97319570
2-[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-4-yl]acetic acid
CID 79612699
imidazo[1,2-a]pyridin-2-yl-(3-phenylpyrrolidin-1-yl)methanone
CID 46981584
4-[(3S)-2-oxo-1-propan-2-ylpiperidin-3-yl]-N-pyridin-4-ylpiperazine-1-carboxamide
CID 97344495
ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate
CID 87051265
[4-(2,5-dimethylphenyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-ylmethanone
CID 87051259
[(3S)-1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-naphthalen-2-ylmethanone
CID 42518126
[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-imidazo[1,2-a]pyridin-2-ylmethanone
CID 66261240
imidazo[1,2-a]pyridin-2-yl-(2-pyridin-3-ylpyrrolidin-1-yl)methanone
CID 53193496

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one?
The IUPAC name of (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one (CID 97342768) is (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one.
What is the SMILES notation for (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one?
The canonical SMILES for (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one is CC(C)N1CCC[C@@H](N2CCN(C(=O)c3cn4ccccc4n3)CC2)C1=O.
What is the InChIKey of (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one?
The InChIKey is HWAIVUPTHHNEGG-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H27N5O2/c1-15(2)25-9-5-6-17(20(25)27)22-10-12-23(13-11-22)19(26)16-14-24-8-4-3-7-18(24)21-16/h3-4,7-8,14-15,17H,5-6,9-13H2,1-2H3/t17-/m1/s1.
What are the key properties of (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one?
(3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one has a molecular weight of 369.47 g/mol, XLogP of 1.49, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[4-(imidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]-1-propan-2-ylpiperidin-2-one is sourced from PubChem (CID 97342768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).