N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide

C16H20N4O — CID 103806535

IUPACN-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide
SMILESCCCN(C(=O)c1cnc2ccccc2n1)C1CCNC1
InChIInChI=1S/C16H20N4O/c1-2-9-20(12-7-8-17-10-12)16(21)15-11-18-13-5-3-4-6-14(13)19-15/h3-6,11-12,17H,2,7-10H2,1H3
InChIKeyZFBJQXSHKQTFIN-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.84
Rot. Bonds4

About N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide

N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide (PubChem CID 103806535) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide
PubChem CID103806535
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide
SMILESCCCN(C(=O)c1cnc2ccccc2n1)C1CCNC1
InChIInChI=1S/C16H20N4O/c1-2-9-20(12-7-8-17-10-12)16(21)15-11-18-13-5-3-4-6-14(13)19-15/h3-6,11-12,17H,2,7-10H2,1H3
InChIKeyZFBJQXSHKQTFIN-UHFFFAOYSA-N
XLogP1.84
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119531290
N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122
4-(benzimidazol-1-yl)-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 119530528
4-phenoxy-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide
CID 119531895
2-methyl-N-propyl-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 106753627
N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 119530984
1-N,1-N-dimethyl-3-N-propyl-3-N-pyrrolidin-3-ylbenzene-1,3-dicarboxamide
CID 119533174
6-oxo-N-propyl-N-pyrrolidin-3-yl-1H-pyridine-3-carboxamide
CID 63300842
4-bromo-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119532826
4-methyl-N-propyl-2-pyrimidin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533114
N,2-dipropyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119533233
5-fluoro-N-piperidin-3-yl-N-propylpyridine-2-carboxamide
CID 104639262

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide?
The IUPAC name of N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide (CID 103806535) is N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide.
What is the SMILES notation for N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide?
The canonical SMILES for N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide is CCCN(C(=O)c1cnc2ccccc2n1)C1CCNC1.
What is the InChIKey of N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide?
The InChIKey is ZFBJQXSHKQTFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-9-20(12-7-8-17-10-12)16(21)15-11-18-13-5-3-4-6-14(13)19-15/h3-6,11-12,17H,2,7-10H2,1H3.
What are the key properties of N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide?
N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide is sourced from PubChem (CID 103806535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).