5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide

C15H24N4O2 — CID 62170112

IUPAC5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCCNc1cnc(C(C)C)nc1C(=O)NC1CCOCC1
InChIInChI=1S/C15H24N4O2/c1-4-16-12-9-17-14(10(2)3)19-13(12)15(20)18-11-5-7-21-8-6-11/h9-11,16H,4-8H2,1-3H3,(H,18,20)
InChIKeyCWOFNGUHTDSJEG-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.94
Rot. Bonds5

About 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide

5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide (PubChem CID 62170112) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide
PubChem CID62170112
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCCNc1cnc(C(C)C)nc1C(=O)NC1CCOCC1
InChIInChI=1S/C15H24N4O2/c1-4-16-12-9-17-14(10(2)3)19-13(12)15(20)18-11-5-7-21-8-6-11/h9-11,16H,4-8H2,1-3H3,(H,18,20)
InChIKeyCWOFNGUHTDSJEG-UHFFFAOYSA-N
XLogP1.94
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide (CID 62170112) is 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide is CCNc1cnc(C(C)C)nc1C(=O)NC1CCOCC1.
What is the InChIKey of 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide?
The InChIKey is CWOFNGUHTDSJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-16-12-9-17-14(10(2)3)19-13(12)15(20)18-11-5-7-21-8-6-11/h9-11,16H,4-8H2,1-3H3,(H,18,20).
What are the key properties of 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide?
5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(oxan-4-yl)-2-propan-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 62170112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).