N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide

C11H17N5O — CID 80793366

IUPACN-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNc1nccc(NCC(=O)NC2CC2)n1
InChIInChI=1S/C11H17N5O/c1-2-12-11-13-6-5-9(16-11)14-7-10(17)15-8-3-4-8/h5-6,8H,2-4,7H2,1H3,(H,15,17)(H2,12,13,14,16)
InChIKeyFWYAQABDOZXKAU-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.60
Rot. Bonds6

About N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide

N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80793366) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80793366
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC NameN-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNc1nccc(NCC(=O)NC2CC2)n1
InChIInChI=1S/C11H17N5O/c1-2-12-11-13-6-5-9(16-11)14-7-10(17)15-8-3-4-8/h5-6,8H,2-4,7H2,1H3,(H,15,17)(H2,12,13,14,16)
InChIKeyFWYAQABDOZXKAU-UHFFFAOYSA-N
XLogP0.60
TPSA78.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-[[2-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80849792
2-[(2-chloropyrimidin-4-yl)amino]-N-cyclopropylacetamide
CID 62344056
methyl 4-[[2-(cyclopropylamino)-2-oxoethyl]amino]pyrimidine-2-carboxylate
CID 66287042
N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955065
3-[[[2-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclobutan-1-ol
CID 80856561
3-[[2-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80787264
3-[(2-aminopyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 80849638
4-N-cyclopropyl-2-N-propylpyrimidine-2,4-diamine
CID 80765650
N-cyclopropyl-2-[[4-(trifluoromethyl)-2-pyridinyl]amino]acetamide
CID 66329445
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-cyclopropylacetamide
CID 43568213
2-[(2-aminopyrimidin-4-yl)amino]-N-ethylacetamide
CID 80787810
1-[[2-(ethylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80779056

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide (CID 80793366) is N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide is CCNc1nccc(NCC(=O)NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is FWYAQABDOZXKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-2-12-11-13-6-5-9(16-11)14-7-10(17)15-8-3-4-8/h5-6,8H,2-4,7H2,1H3,(H,15,17)(H2,12,13,14,16).
What are the key properties of N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide?
N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 235.29 g/mol, XLogP of 0.60, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(ethylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80793366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).