N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide

C16H14ClN5O3 — CID 142922416

IUPACN-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide
SMILESCN(C)c1nccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC=O)c12
InChIInChI=1S/C16H14ClN5O3/c1-22(2)15-12-10(5-6-18-15)25-14(13(12)20-8-23)16(24)21-11-4-3-9(17)7-19-11/h3-8H,1-2H3,(H,20,23)(H,19,21,24)
InChIKeyQRPAVKUDESSGMD-UHFFFAOYSA-N
MW359.77 g/mol
LogP2.76
Rot. Bonds5

About N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide

N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide (PubChem CID 142922416) has the molecular formula C16H14ClN5O3 and a molecular weight of 359.77 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide
PubChem CID142922416
Molecular FormulaC16H14ClN5O3
Molecular Weight359.77 g/mol
Exact Mass359.08
IUPAC NameN-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide
SMILESCN(C)c1nccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC=O)c12
InChIInChI=1S/C16H14ClN5O3/c1-22(2)15-12-10(5-6-18-15)25-14(13(12)20-8-23)16(24)21-11-4-3-9(17)7-19-11/h3-8H,1-2H3,(H,20,23)(H,19,21,24)
InChIKeyQRPAVKUDESSGMD-UHFFFAOYSA-N
XLogP2.76
TPSA100.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.77
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-(5-chloro-2-pyridinyl)-3-[[4-(dimethylamino)cyclohexanecarbonyl]amino]-1-benzofuran-2-carboxamide;dihydrochloride
CID 23062731
methyl 4-[[2-[(5-chloro-2-pyridinyl)carbamoyl]-1-benzofuran-3-yl]amino]oxybutanoate
CID 142681920
N-(5-chloro-2-pyridinyl)-3-[[4-(methylamino)cyclohexanecarbonyl]amino]furo[3,2-b]pyridine-2-carboxamide;trihydrochloride
CID 23088716
3-amino-2-[(5-chloro-2-pyridinyl)carbamoyl]-1-benzofuran-5-carboxylic acid
CID 23062593
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
N-[2-[(5-chloro-2-pyridinyl)carbamoyl]-1-benzofuran-3-yl]piperidine-4-carboxamide
CID 23062699
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-(5-chloro-2-pyridinyl)-3-[[2-(4-pyrrolidin-1-ylcyclohexyl)acetyl]amino]furo[3,2-b]pyridine-2-carboxamide
CID 163779769
3-[[4-[acetyl(propan-2-yl)amino]cyclohexanecarbonyl]amino]-N-(5-chloro-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 23062669
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
3-amino-N-(5-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 61094139
5-chloro-3-(methylamino)-N-(5-methyl-2-pyridinyl)furo[3,2-b]pyridine-2-carboxamide;4-(dimethylamino)cyclohexane-1-carbaldehyde
CID 142922367

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide (CID 142922416) is N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide is CN(C)c1nccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC=O)c12.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide?
The InChIKey is QRPAVKUDESSGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN5O3/c1-22(2)15-12-10(5-6-18-15)25-14(13(12)20-8-23)16(24)21-11-4-3-9(17)7-19-11/h3-8H,1-2H3,(H,20,23)(H,19,21,24).
What are the key properties of N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide?
N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide has a molecular weight of 359.77 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-4-(dimethylamino)-3-formamidofuro[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 142922416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).