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

C15H13N5O2 — CID 11312454

IUPAC2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide
SMILESNc1nc(C(=O)NCc2ccncc2)cc(-c2ccco2)n1
InChIInChI=1S/C15H13N5O2/c16-15-19-11(13-2-1-7-22-13)8-12(20-15)14(21)18-9-10-3-5-17-6-4-10/h1-8H,9H2,(H,18,21)(H2,16,19,20)
InChIKeyOVPOEJWCXDGJTP-UHFFFAOYSA-N
MW295.30 g/mol
LogP1.64
Rot. Bonds4

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

2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 11312454) has the molecular formula C15H13N5O2 and a molecular weight of 295.30 g/mol. Its IUPAC name is 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide
PubChem CID11312454
Molecular FormulaC15H13N5O2
Molecular Weight295.30 g/mol
Exact Mass295.11
IUPAC Name2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide
SMILESNc1nc(C(=O)NCc2ccncc2)cc(-c2ccco2)n1
InChIInChI=1S/C15H13N5O2/c16-15-19-11(13-2-1-7-22-13)8-12(20-15)14(21)18-9-10-3-5-17-6-4-10/h1-8H,9H2,(H,18,21)(H2,16,19,20)
InChIKeyOVPOEJWCXDGJTP-UHFFFAOYSA-N
XLogP1.64
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Las-38096
CID 11716665
Pyrimidine-4-carboxamide, 118
CID 44520982
Pyrimidine-4-carboxamide, 26
CID 11220580
Pyrimidine-4-carboxamide, 109
CID 11324754
Pyrimidine-4-carboxamide, 117
CID 11381773
Pyrimidine-4-carboxamide, 25
CID 11426423
4-(furan-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 21976428
Pyrimidine-4-carboxamide, 27
CID 44520941
4-Pyrimidinecarboxamide,6-(5-methyl-2-furanyl)-n-(2-pyridinylmethyl)-
CID 44520975
4-Pyrimidinecarboxamide,2-amino-6-(5-methyl-2-furanyl)-n-[(6-methyl-2-pyridinyl)methyl]-
CID 44520976
Pyrimidine-4-carboxamide, 115
CID 44520980
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)acetamide
CID 46880333

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide (CID 11312454) is 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide is Nc1nc(C(=O)NCc2ccncc2)cc(-c2ccco2)n1.
What is the InChIKey of 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is OVPOEJWCXDGJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O2/c16-15-19-11(13-2-1-7-22-13)8-12(20-15)14(21)18-9-10-3-5-17-6-4-10/h1-8H,9H2,(H,18,21)(H2,16,19,20).
What are the key properties of 2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide?
2-amino-6-(furan-2-yl)-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 295.30 g/mol, XLogP of 1.64, 4 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-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 11312454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).