2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide

C14H23N5O — CID 80982786

IUPAC2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCNc1nc(C2CC2)nc(NC(C)(C)C(N)=O)c1C
InChIInChI=1S/C14H23N5O/c1-5-16-10-8(2)11(19-14(3,4)13(15)20)18-12(17-10)9-6-7-9/h9H,5-7H2,1-4H3,(H2,15,20)(H2,16,17,18,19)
InChIKeyINXJOGJMIBCOCF-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.77
Rot. Bonds6

About 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide

2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide (PubChem CID 80982786) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
PubChem CID80982786
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCNc1nc(C2CC2)nc(NC(C)(C)C(N)=O)c1C
InChIInChI=1S/C14H23N5O/c1-5-16-10-8(2)11(19-14(3,4)13(15)20)18-12(17-10)9-6-7-9/h9H,5-7H2,1-4H3,(H2,15,20)(H2,16,17,18,19)
InChIKeyINXJOGJMIBCOCF-UHFFFAOYSA-N
XLogP1.77
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
CID 80982855
4-N-butyl-2-cyclopropyl-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80981195
3-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-N,N-dimethylpropanamide
CID 80984218
3-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-3-methylbutanamide
CID 106098766
2-cyclopropyl-6-N-ethyl-4-N-hexyl-5-methylpyrimidine-4,6-diamine
CID 80985625
2-cyclopropyl-4-N-(2,3-dimethylbutyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985256
2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-methylpropan-1-ol
CID 80995092
2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-methylbutan-1-ol
CID 81006717
1-[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]pyrazole-4-carboxamide
CID 80988659
ethyl 2-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]acetate
CID 80993671
ethyl 2-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]acetate
CID 80995205
2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine
CID 80976188

Frequently Asked Questions

What is the IUPAC name of 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The IUPAC name of 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide (CID 80982786) is 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide.
What is the SMILES notation for 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The canonical SMILES for 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide is CCNc1nc(C2CC2)nc(NC(C)(C)C(N)=O)c1C.
What is the InChIKey of 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The InChIKey is INXJOGJMIBCOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-5-16-10-8(2)11(19-14(3,4)13(15)20)18-12(17-10)9-6-7-9/h9H,5-7H2,1-4H3,(H2,15,20)(H2,16,17,18,19).
What are the key properties of 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 1.77, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide is sourced from PubChem (CID 80982786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).