2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide

C15H16N6O2 — CID 59022880

IUPAC2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccn(C)n3)nc(N)n2)o1
InChIInChI=1S/C15H16N6O2/c1-9-3-4-13(23-9)11-7-12(19-15(16)18-11)14(22)17-8-10-5-6-21(2)20-10/h3-7H,8H2,1-2H3,(H,17,22)(H2,16,18,19)
InChIKeyALTLNUPFIPXHSW-UHFFFAOYSA-N
MW312.33 g/mol
LogP1.29
Rot. Bonds4

About 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide

2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide (PubChem CID 59022880) has the molecular formula C15H16N6O2 and a molecular weight of 312.33 g/mol. Its IUPAC name is 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide
PubChem CID59022880
Molecular FormulaC15H16N6O2
Molecular Weight312.33 g/mol
Exact Mass312.13
IUPAC Name2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccn(C)n3)nc(N)n2)o1
InChIInChI=1S/C15H16N6O2/c1-9-3-4-13(23-9)11-7-12(19-15(16)18-11)14(22)17-8-10-5-6-21(2)20-10/h3-7H,8H2,1-2H3,(H,17,22)(H2,16,18,19)
InChIKeyALTLNUPFIPXHSW-UHFFFAOYSA-N
XLogP1.29
TPSA111.86 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-N-[(4,6-dimethyl-2-pyridinyl)methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
CID 44520978
2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
CID 59022902
2-amino-6-(5-methylfuran-2-yl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]pyrimidine-4-carboxamide
CID 44520985
2-amino-N-hexyl-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
CID 59022894
2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 11403877
5-amino-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 82882259
2-fluoro-5-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 82882306
2-amino-6-chloro-N-[(1-methylpyrazol-3-yl)methyl]pyridine-4-carboxamide
CID 82874567
1-(2-aminoethyl)-N-[(1-methylpyrazol-3-yl)methyl]triazole-4-carboxamide
CID 82873730
6-amino-N-[(1-methylpyrazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
CID 103543335
3,4-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 19330914
2,6-dichloro-N-[(1-methylpyrazol-3-yl)methyl]pyridine-4-carboxamide
CID 82882213

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide (CID 59022880) is 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide is Cc1ccc(-c2cc(C(=O)NCc3ccn(C)n3)nc(N)n2)o1.
What is the InChIKey of 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide?
The InChIKey is ALTLNUPFIPXHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2/c1-9-3-4-13(23-9)11-7-12(19-15(16)18-11)14(22)17-8-10-5-6-21(2)20-10/h3-7H,8H2,1-2H3,(H,17,22)(H2,16,18,19).
What are the key properties of 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide?
2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 59022880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).