N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide

C17H29N5O4 — CID 8542278

IUPACN-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide
SMILESCCCCN(C(=O)CN1CCOCC1)c1c(N)n(CCC)c(=O)[nH]c1=O
InChIInChI=1S/C17H29N5O4/c1-3-5-7-21(13(23)12-20-8-10-26-11-9-20)14-15(18)22(6-4-2)17(25)19-16(14)24/h3-12,18H2,1-2H3,(H,19,24,25)
InChIKeyQEMPBXUUZYUOOF-UHFFFAOYSA-N
MW367.45 g/mol
LogP-0.01
Rot. Bonds8

About N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide

N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide (PubChem CID 8542278) has the molecular formula C17H29N5O4 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide
PubChem CID8542278
Molecular FormulaC17H29N5O4
Molecular Weight367.45 g/mol
Exact Mass367.22
IUPAC NameN-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide
SMILESCCCCN(C(=O)CN1CCOCC1)c1c(N)n(CCC)c(=O)[nH]c1=O
InChIInChI=1S/C17H29N5O4/c1-3-5-7-21(13(23)12-20-8-10-26-11-9-20)14-15(18)22(6-4-2)17(25)19-16(14)24/h3-12,18H2,1-2H3,(H,19,24,25)
InChIKeyQEMPBXUUZYUOOF-UHFFFAOYSA-N
XLogP-0.01
TPSA113.66 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide?
The IUPAC name of N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide (CID 8542278) is N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide is CCCCN(C(=O)CN1CCOCC1)c1c(N)n(CCC)c(=O)[nH]c1=O.
What is the InChIKey of N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide?
The InChIKey is QEMPBXUUZYUOOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O4/c1-3-5-7-21(13(23)12-20-8-10-26-11-9-20)14-15(18)22(6-4-2)17(25)19-16(14)24/h3-12,18H2,1-2H3,(H,19,24,25).
What are the key properties of N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide?
N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide has a molecular weight of 367.45 g/mol, XLogP of -0.01, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-morpholin-4-ylacetamide is sourced from PubChem (CID 8542278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).