N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide

C15H27N5O — CID 80942500

IUPACN-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCCNC(=O)CNc1cc(NCCC)nc(CCC)n1
InChIInChI=1S/C15H27N5O/c1-4-7-12-19-13(16-8-5-2)10-14(20-12)18-11-15(21)17-9-6-3/h10H,4-9,11H2,1-3H3,(H,17,21)(H2,16,18,19,20)
InChIKeyGWFFLMCWQOWZBY-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.19
Rot. Bonds10

About N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide

N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80942500) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80942500
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC NameN-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCCNC(=O)CNc1cc(NCCC)nc(CCC)n1
InChIInChI=1S/C15H27N5O/c1-4-7-12-19-13(16-8-5-2)10-14(20-12)18-11-15(21)17-9-6-3/h10H,4-9,11H2,1-3H3,(H,17,21)(H2,16,18,19,20)
InChIKeyGWFFLMCWQOWZBY-UHFFFAOYSA-N
XLogP2.19
TPSA78.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80954429
2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]-N-methylacetamide
CID 80955338
3-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80954256
N-methyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955339
methyl 3-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]propanoate
CID 80954586
4-N-butyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80946225
6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
CID 80946214
2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-N-propylacetamide
CID 80905733
2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80945317
N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955065
2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241892
2-[[6-(ethylamino)-2-pyridinyl]amino]-N-propylacetamide
CID 80787440

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide (CID 80942500) is N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide is CCCNC(=O)CNc1cc(NCCC)nc(CCC)n1.
What is the InChIKey of N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is GWFFLMCWQOWZBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-4-7-12-19-13(16-8-5-2)10-14(20-12)18-11-15(21)17-9-6-3/h10H,4-9,11H2,1-3H3,(H,17,21)(H2,16,18,19,20).
What are the key properties of N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide?
N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 293.41 g/mol, XLogP of 2.19, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80942500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).