N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide

C16H17N5O3 — CID 30295845

IUPACN-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncn(C)c(=O)c2c1C(=O)Nc1ccc(N(C)C)nc1
InChIInChI=1S/C16H17N5O3/c1-9-12(13-15(24-9)18-8-21(4)16(13)23)14(22)19-10-5-6-11(17-7-10)20(2)3/h5-8H,1-4H3,(H,19,22)
InChIKeyWSMREYVBMYNWEZ-UHFFFAOYSA-N
MW327.34 g/mol
LogP1.55
Rot. Bonds3

About N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide

N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide (PubChem CID 30295845) has the molecular formula C16H17N5O3 and a molecular weight of 327.34 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
PubChem CID30295845
Molecular FormulaC16H17N5O3
Molecular Weight327.34 g/mol
Exact Mass327.13
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncn(C)c(=O)c2c1C(=O)Nc1ccc(N(C)C)nc1
InChIInChI=1S/C16H17N5O3/c1-9-12(13-15(24-9)18-8-21(4)16(13)23)14(22)19-10-5-6-11(17-7-10)20(2)3/h5-8H,1-4H3,(H,19,22)
InChIKeyWSMREYVBMYNWEZ-UHFFFAOYSA-N
XLogP1.55
TPSA93.26 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide with MolForge

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Related Compounds

6-Methyl-3-(2-methylpropyl)-N-(5-methylpyridin-2-YL)-4-oxo-3H,4H-furo[2,3-D]pyrimidine-5-carboxamide
CID 16023780
(2,5-Dimethylfuran-3-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 1245848
(2,5-Dimethyl-3-furyl){4-[5-(trifluoromethyl)-2-pyridinyl]piperazino}methanone
CID 2811732
N-(3-Ethylphenyl)-6-methyl-4-(piperidin-1-YL)furo[2,3-D]pyrimidine-5-carboxamide
CID 16023888
3,6-dimethyl-4-oxo-N~5~-(2-pyridyl)-3,4-dihydrofuro[2,3-d]pyrimidine-5-carboxamide
CID 16009470
6-Methyl-3-(2-methylpropyl)-N-(6-methylpyridin-2-YL)-4-oxo-3H,4H-furo[2,3-D]pyrimidine-5-carboxamide
CID 16023690
N-Ethyl-2-[4-(2-pyridinylamino)phenoxy]-3-pyridinecarboxamide
CID 59374142
N-Propyl-2-[4-(2-pyridinylamino)phenoxy]-3-pyridinecarboxamide
CID 59374161
N-(2-Methyl-2-propen-1-yl)-2-[4-(2-pyridinylamino)phenoxy]-3-pyridinecarboxamide
CID 59374205
N-[2-(1-Methyl-2-pyrrolidinyl)ethyl]-2-[4-(2-pyridinylamino)phenoxy]-3-pyridinecarboxamide
CID 59374208
N-(cyanomethyl)-N-methyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
CID 59374288
(2,5-Dihydro-1H-pyrrol-1-yl)[2-[4-(2-pyridinylamino)phenoxy]-3-pyridinyl]methanone
CID 59374339

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide (CID 30295845) is N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide is Cc1oc2ncn(C)c(=O)c2c1C(=O)Nc1ccc(N(C)C)nc1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is WSMREYVBMYNWEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O3/c1-9-12(13-15(24-9)18-8-21(4)16(13)23)14(22)19-10-5-6-11(17-7-10)20(2)3/h5-8H,1-4H3,(H,19,22).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide?
N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 327.34 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 30295845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).