N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide

C13H20N4O2 — CID 166082435

IUPACN-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide
SMILESC[C@H](CO)NC(=O)c1ccc(N2CCNCC2)cn1
InChIInChI=1S/C13H20N4O2/c1-10(9-18)16-13(19)12-3-2-11(8-15-12)17-6-4-14-5-7-17/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,16,19)/t10-/m1/s1
InChIKeyGFDGJCCQDSBCNS-SNVBAGLBSA-N
MW264.33 g/mol
LogP-0.40
Rot. Bonds4

About N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide

N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide (PubChem CID 166082435) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide
PubChem CID166082435
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide
SMILESC[C@H](CO)NC(=O)c1ccc(N2CCNCC2)cn1
InChIInChI=1S/C13H20N4O2/c1-10(9-18)16-13(19)12-3-2-11(8-15-12)17-6-4-14-5-7-17/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,16,19)/t10-/m1/s1
InChIKeyGFDGJCCQDSBCNS-SNVBAGLBSA-N
XLogP-0.40
TPSA77.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-piperazin-1-ylpyridine-2-carboxamide
CID 155586911
N-(2-methoxyethyl)-5-piperazin-1-ylpyridine-2-carboxamide
CID 166082465
N-butan-2-yl-5-morpholin-4-ylpyridine-2-carboxamide
CID 109181400
1-(5-piperazin-1-yl-2-pyridinyl)ethanone
CID 79020099
5-[4-(4-fluorophenyl)piperazin-1-yl]-N-propan-2-ylpyridine-2-carboxamide
CID 109179488
5-[3-(hydroxymethyl)piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 167179178
N-methyl-1-(5-piperazin-1-yl-2-pyridinyl)ethenamine
CID 169189713
5-[4-(3-chlorophenyl)piperazin-1-yl]-N-propan-2-ylpyridine-2-carboxamide
CID 109179502
N-[(3S)-2-oxopiperidin-3-yl]-5-piperazin-1-ylpyridine-2-carboxamide
CID 171564714
5-chloro-N-[(2S)-1-hydroxypropan-2-yl]pyrazine-2-carboxamide
CID 107258262
5-(azepan-1-yl)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109195506
N-(1-phenylethyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-2-carboxamide
CID 109188874

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide (CID 166082435) is N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide is C[C@H](CO)NC(=O)c1ccc(N2CCNCC2)cn1.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide?
The InChIKey is GFDGJCCQDSBCNS-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-10(9-18)16-13(19)12-3-2-11(8-15-12)17-6-4-14-5-7-17/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,16,19)/t10-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide?
N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -0.40, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 166082435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).