N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide

C19H22N4O — CID 170439373

IUPACN-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide
SMILESO=C(NCC1CC1)N1CCN(Cc2ccccn2)c2ccccc21
InChIInChI=1S/C19H22N4O/c24-19(21-13-15-8-9-15)23-12-11-22(14-16-5-3-4-10-20-16)17-6-1-2-7-18(17)23/h1-7,10,15H,8-9,11-14H2,(H,21,24)
InChIKeyCJOMGQWVOHEFDF-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.03
Rot. Bonds4

About N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide

N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide (PubChem CID 170439373) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide
PubChem CID170439373
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide
SMILESO=C(NCC1CC1)N1CCN(Cc2ccccn2)c2ccccc21
InChIInChI=1S/C19H22N4O/c24-19(21-13-15-8-9-15)23-12-11-22(14-16-5-3-4-10-20-16)17-6-1-2-7-18(17)23/h1-7,10,15H,8-9,11-14H2,(H,21,24)
InChIKeyCJOMGQWVOHEFDF-UHFFFAOYSA-N
XLogP3.03
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxan-4-ylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide
CID 170439357
2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 71985240
N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16896080
2-[(3aR,7S,7aS)-2-(pyridin-2-ylmethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-7-yl]-N-(cyclopropylmethyl)acetamide
CID 97379887
2-(cyclopropylmethylamino)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
CID 119901369
2-(3-methylphenyl)-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]acetamide
CID 16896062
N-(cyclopropylmethyl)-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 78921206
N-(cyclopropylmethyl)-2-[(4S)-1'-(pyridin-2-ylmethyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl]acetamide
CID 97376222
N'-(4-acetamidophenyl)-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]oxamide
CID 16887250
4-methoxy-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895998
N-(cyclopropylmethyl)-2-[(1R)-1'-(pyridin-2-ylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97375807
4-cyano-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16896060

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide (CID 170439373) is N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide is O=C(NCC1CC1)N1CCN(Cc2ccccn2)c2ccccc21.
What is the InChIKey of N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide?
The InChIKey is CJOMGQWVOHEFDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c24-19(21-13-15-8-9-15)23-12-11-22(14-16-5-3-4-10-20-16)17-6-1-2-7-18(17)23/h1-7,10,15H,8-9,11-14H2,(H,21,24).
What are the key properties of N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide?
N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)-2,3-dihydroquinoxaline-1-carboxamide is sourced from PubChem (CID 170439373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).