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

C15H18N4O3 — CID 11403877

IUPAC2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCC3CCCO3)nc(N)n2)o1
InChIInChI=1S/C15H18N4O3/c1-9-4-5-13(22-9)11-7-12(19-15(16)18-11)14(20)17-8-10-3-2-6-21-10/h4-5,7,10H,2-3,6,8H2,1H3,(H,17,20)(H2,16,18,19)
InChIKeyXGRPCUZOZAGGFS-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.54
Rot. Bonds4

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

2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 11403877) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID11403877
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC Name2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCC3CCCO3)nc(N)n2)o1
InChIInChI=1S/C15H18N4O3/c1-9-4-5-13(22-9)11-7-12(19-15(16)18-11)14(20)17-8-10-3-2-6-21-10/h4-5,7,10H,2-3,6,8H2,1H3,(H,17,20)(H2,16,18,19)
InChIKeyXGRPCUZOZAGGFS-UHFFFAOYSA-N
XLogP1.54
TPSA103.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-dimethyl-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 110849464
2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide
CID 59022880
2-N,6-N-bis(oxolan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 4668561
5-(4-methylphenyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,2-oxazole-3-carboxamide
CID 1093775
4-amino-3-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 16789376
4-methyl-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 110849466
2-amino-N-[[6-(methoxymethyl)-2-pyridinyl]methyl]-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
CID 59022902
6-methyl-2-[(4-methylphenyl)methylamino]-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109324696
2-methyl-N-(oxolan-2-ylmethyl)-6-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 109360386
2-methyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109365986
6-methyl-N-(oxolan-2-ylmethyl)-2-(pyridin-4-ylmethylamino)pyrimidine-4-carboxamide
CID 109324709
6-[(4-methoxyphenyl)methylamino]-2-methyl-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109365850

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide (CID 11403877) is 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide is Cc1ccc(-c2cc(C(=O)NCC3CCCO3)nc(N)n2)o1.
What is the InChIKey of 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is XGRPCUZOZAGGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-9-4-5-13(22-9)11-7-12(19-15(16)18-11)14(20)17-8-10-3-2-6-21-10/h4-5,7,10H,2-3,6,8H2,1H3,(H,17,20)(H2,16,18,19).
What are the key properties of 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 11403877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).