(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide

C16H21N5O2 — CID 125169595

IUPAC(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide
SMILESCC(C)N1C[C@H](C(=O)NCc2cnc3cnccn23)CCC1=O
InChIInChI=1S/C16H21N5O2/c1-11(2)21-10-12(3-4-15(21)22)16(23)19-8-13-7-18-14-9-17-5-6-20(13)14/h5-7,9,11-12H,3-4,8,10H2,1-2H3,(H,19,23)/t12-/m1/s1
InChIKeyQFJRNCJAQGRSJY-GFCCVEGCSA-N
MW315.38 g/mol
LogP0.99
Rot. Bonds4

About (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide

(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide (PubChem CID 125169595) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide
PubChem CID125169595
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide
SMILESCC(C)N1C[C@H](C(=O)NCc2cnc3cnccn23)CCC1=O
InChIInChI=1S/C16H21N5O2/c1-11(2)21-10-12(3-4-15(21)22)16(23)19-8-13-7-18-14-9-17-5-6-20(13)14/h5-7,9,11-12H,3-4,8,10H2,1-2H3,(H,19,23)/t12-/m1/s1
InChIKeyQFJRNCJAQGRSJY-GFCCVEGCSA-N
XLogP0.99
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)spiro[2.5]octane-2-carboxamide
CID 126424942
N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-1-methylpyrrole-2-carboxamide
CID 90653495
(5S)-5-(6-methyl-1,3-dihydropyrrolo[3,4-c]pyridine-2-carbonyl)-1-propan-2-ylpiperidin-2-one
CID 125163334
(3R)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 95127546
1-(cyclohexylmethyl)-6-oxo-N-[(1-propan-2-ylimidazol-2-yl)methyl]piperidine-3-carboxamide
CID 72914179
5-oxo-1-propan-2-yl-N-[(2-pyridin-3-yl-1,3-thiazol-4-yl)methyl]pyrrolidine-3-carboxamide
CID 108770960
(3R)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 36885410
5-oxo-1-propan-2-yl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 49355941
N-(cyclohexen-1-ylmethyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 70713492
3-(4-fluorophenyl)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-3-phenylpropanamide
CID 119074275
1-butan-2-yl-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 113182112
4-(imidazo[1,2-a]pyrazin-3-ylmethylamino)-1-(3-methoxyphenyl)pyrrolidin-2-one
CID 154750941

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide?
The IUPAC name of (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide (CID 125169595) is (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide is CC(C)N1C[C@H](C(=O)NCc2cnc3cnccn23)CCC1=O.
What is the InChIKey of (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide?
The InChIKey is QFJRNCJAQGRSJY-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-11(2)21-10-12(3-4-15(21)22)16(23)19-8-13-7-18-14-9-17-5-6-20(13)14/h5-7,9,11-12H,3-4,8,10H2,1-2H3,(H,19,23)/t12-/m1/s1.
What are the key properties of (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide?
(3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-oxo-1-propan-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 125169595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).