2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide

C20H24N4O — CID 71985240

IUPAC2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CN1CCN(CC2CC2)c2ccccc21)NCc1ccccn1
InChIInChI=1S/C20H24N4O/c25-20(22-13-17-5-3-4-10-21-17)15-24-12-11-23(14-16-8-9-16)18-6-1-2-7-19(18)24/h1-7,10,16H,8-9,11-15H2,(H,22,25)
InChIKeyNJQNATMHASFFBV-UHFFFAOYSA-N
MW336.44 g/mol
LogP2.43
Rot. Bonds6

About 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide

2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 71985240) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID71985240
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CN1CCN(CC2CC2)c2ccccc21)NCc1ccccn1
InChIInChI=1S/C20H24N4O/c25-20(22-13-17-5-3-4-10-21-17)15-24-12-11-23(14-16-8-9-16)18-6-1-2-7-19(18)24/h1-7,10,16H,8-9,11-15H2,(H,22,25)
InChIKeyNJQNATMHASFFBV-UHFFFAOYSA-N
XLogP2.43
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 79333901
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide
CID 170439373
2-(4-benzylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 46488455
2-(6,11-dioxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 78149585
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 46056291
2-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95609233
2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 141007627
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 56803059
2-[(2S)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626153
2-[(3R)-3-[[(2R)-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626413
2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 110851953

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide (CID 71985240) is 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide is O=C(CN1CCN(CC2CC2)c2ccccc21)NCc1ccccn1.
What is the InChIKey of 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is NJQNATMHASFFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c25-20(22-13-17-5-3-4-10-21-17)15-24-12-11-23(14-16-8-9-16)18-6-1-2-7-19(18)24/h1-7,10,16H,8-9,11-15H2,(H,22,25).
What are the key properties of 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide?
2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 336.44 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 71985240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).