(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide

C19H21N5O — CID 931270

IUPAC(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide
SMILESN#C[C@H](C(=O)NC1CC1)c1nc2ccccc2nc1N1CCCCC1
InChIInChI=1S/C19H21N5O/c20-12-14(19(25)21-13-8-9-13)17-18(24-10-4-1-5-11-24)23-16-7-3-2-6-15(16)22-17/h2-3,6-7,13-14H,1,4-5,8-11H2,(H,21,25)/t14-/m0/s1
InChIKeyYTTGVQINZCUQAD-AWEZNQCLSA-N
MW335.41 g/mol
LogP2.51
Rot. Bonds4

About (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide

(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide (PubChem CID 931270) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide.

Molecular Properties

Compound Name(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide
PubChem CID931270
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide
SMILESN#C[C@H](C(=O)NC1CC1)c1nc2ccccc2nc1N1CCCCC1
InChIInChI=1S/C19H21N5O/c20-12-14(19(25)21-13-8-9-13)17-18(24-10-4-1-5-11-24)23-16-7-3-2-6-15(16)22-17/h2-3,6-7,13-14H,1,4-5,8-11H2,(H,21,25)/t14-/m0/s1
InChIKeyYTTGVQINZCUQAD-AWEZNQCLSA-N
XLogP2.51
TPSA81.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methylpiperidin-1-yl]quinoxalin-2-yl]acetamide
CID 7367775
(2S)-2-cyano-N-cyclohexyl-2-[3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]acetamide
CID 6579345
2-cyano-N-cyclopropyl-2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]acetamide
CID 4123187
N-butyl-2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide
CID 3606790
2-cyano-N-hexyl-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide
CID 2999890
2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(thiophen-2-ylmethyl)acetamide
CID 71559907
(2R)-2-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinoxalin-2-yl]-2-cyano-N-cyclohexylacetamide
CID 40838073
2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 71561049
2-[3-(azepan-1-yl)quinoxalin-2-yl]propanedinitrile
CID 23958780
methyl (2S)-2-cyano-2-[3-[(3S)-3-methylpiperidin-1-yl]quinoxalin-2-yl]acetate
CID 6578670
methyl 1-[3-[(1S)-2-(benzylamino)-1-cyano-2-oxoethyl]quinoxalin-2-yl]piperidine-4-carboxylate
CID 40837315
2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]-N-prop-2-enylacetamide
CID 4295438

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide?
The IUPAC name of (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide (CID 931270) is (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide.
What is the SMILES notation for (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide?
The canonical SMILES for (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide is N#C[C@H](C(=O)NC1CC1)c1nc2ccccc2nc1N1CCCCC1.
What is the InChIKey of (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide?
The InChIKey is YTTGVQINZCUQAD-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H21N5O/c20-12-14(19(25)21-13-8-9-13)17-18(24-10-4-1-5-11-24)23-16-7-3-2-6-15(16)22-17/h2-3,6-7,13-14H,1,4-5,8-11H2,(H,21,25)/t14-/m0/s1.
What are the key properties of (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide?
(2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide has a molecular weight of 335.41 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyano-N-cyclopropyl-2-(3-piperidin-1-ylquinoxalin-2-yl)acetamide is sourced from PubChem (CID 931270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).