2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

C18H19N5O2 — CID 44520972

IUPAC2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCc1c(C(=O)NCc2ccccn2)nc(N)nc1-c1ccc(C)o1
InChIInChI=1S/C18H19N5O2/c1-3-13-15(14-8-7-11(2)25-14)22-18(19)23-16(13)17(24)21-10-12-6-4-5-9-20-12/h4-9H,3,10H2,1-2H3,(H,21,24)(H2,19,22,23)
InChIKeyHZJBTXVDTJIKKZ-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.51
Rot. Bonds5

About 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide

2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 44520972) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID44520972
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCc1c(C(=O)NCc2ccccn2)nc(N)nc1-c1ccc(C)o1
InChIInChI=1S/C18H19N5O2/c1-3-13-15(14-8-7-11(2)25-14)22-18(19)23-16(13)17(24)21-10-12-6-4-5-9-20-12/h4-9H,3,10H2,1-2H3,(H,21,24)(H2,19,22,23)
InChIKeyHZJBTXVDTJIKKZ-UHFFFAOYSA-N
XLogP2.51
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide (CID 44520972) is 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is CCc1c(C(=O)NCc2ccccn2)nc(N)nc1-c1ccc(C)o1.
What is the InChIKey of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is HZJBTXVDTJIKKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-3-13-15(14-8-7-11(2)25-14)22-18(19)23-16(13)17(24)21-10-12-6-4-5-9-20-12/h4-9H,3,10H2,1-2H3,(H,21,24)(H2,19,22,23).
What are the key properties of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide?
2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 44520972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).