2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide

C12H14N4O3 — CID 11737091

IUPAC2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C12H14N4O3/c1-18-6-4-14-11(17)9-7-8(15-12(13)16-9)10-3-2-5-19-10/h2-3,5,7H,4,6H2,1H3,(H,14,17)(H2,13,15,16)
InChIKeyQJOCSUQRXLMFAT-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.69
Rot. Bonds5

About 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide

2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide (PubChem CID 11737091) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
PubChem CID11737091
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC Name2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C12H14N4O3/c1-18-6-4-14-11(17)9-7-8(15-12(13)16-9)10-3-2-5-19-10/h2-3,5,7H,4,6H2,1H3,(H,14,17)(H2,13,15,16)
InChIKeyQJOCSUQRXLMFAT-UHFFFAOYSA-N
XLogP0.69
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-(furan-2-yl)-N-(2-methoxyethyl)-1,2-oxazole-3-carboxamide
CID 15995731
2-amino-6-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-4-carboxamide
CID 11416733
[6-[[[2-amino-6-(furan-2-yl)pyrimidine-4-carbonyl]amino]methyl]-2-pyridinyl]methyl N-hexylcarbamate
CID 11385446
2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide
CID 91064332
2-amino-6-(furan-2-yl)-N-(3-methyl-2-pyridinyl)pyrimidine-4-carboxamide
CID 11197188
2-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 11473907
2-amino-N-benzyl-6-(furan-2-yl)-N-methylpyrimidine-4-carboxamide
CID 59022943
2-amino-6-(furan-2-yl)-N-[[(4Z)-5-methylidene-4-prop-2-enylidene-2-pyridinyl]methyl]pyrimidine-4-carboxamide
CID 143092124
5-(furan-2-yl)-N-[2-(2-methoxyethylamino)-2-oxoethyl]-1H-pyrazole-3-carboxamide
CID 86984728
4-(furan-2-yl)-N-(2-methoxyethyl)benzamide
CID 168525529
[2-amino-6-(furan-2-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 11173320
3-(furan-2-yl)-N-(2-methoxyethyl)-1-(3-methylphenyl)pyrazole-5-carboxamide
CID 42762387

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide (CID 11737091) is 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide is COCCNC(=O)c1cc(-c2ccco2)nc(N)n1.
What is the InChIKey of 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide?
The InChIKey is QJOCSUQRXLMFAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-18-6-4-14-11(17)9-7-8(15-12(13)16-9)10-3-2-5-19-10/h2-3,5,7H,4,6H2,1H3,(H,14,17)(H2,13,15,16).
What are the key properties of 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide?
2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 0.69, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 11737091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).