N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide

C14H25N5O — CID 106918503

IUPACN-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide
SMILESCCCc1nc(NC)c(C)c(N(C)CCC(=O)NC)n1
InChIInChI=1S/C14H25N5O/c1-6-7-11-17-13(16-4)10(2)14(18-11)19(5)9-8-12(20)15-3/h6-9H2,1-5H3,(H,15,20)(H,16,17,18)
InChIKeyXUEOYOFTTJTCCC-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.35
Rot. Bonds7

About N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide

N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide (PubChem CID 106918503) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide.

Molecular Properties

Compound NameN-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide
PubChem CID106918503
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide
SMILESCCCc1nc(NC)c(C)c(N(C)CCC(=O)NC)n1
InChIInChI=1S/C14H25N5O/c1-6-7-11-17-13(16-4)10(2)14(18-11)19(5)9-8-12(20)15-3/h6-9H2,1-5H3,(H,15,20)(H,16,17,18)
InChIKeyXUEOYOFTTJTCCC-UHFFFAOYSA-N
XLogP1.35
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide?
The IUPAC name of N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide (CID 106918503) is N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide.
What is the SMILES notation for N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide?
The canonical SMILES for N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide is CCCc1nc(NC)c(C)c(N(C)CCC(=O)NC)n1.
What is the InChIKey of N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide?
The InChIKey is XUEOYOFTTJTCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-6-7-11-17-13(16-4)10(2)14(18-11)19(5)9-8-12(20)15-3/h6-9H2,1-5H3,(H,15,20)(H,16,17,18).
What are the key properties of N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide?
N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide has a molecular weight of 279.39 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide is sourced from PubChem (CID 106918503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).