N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide

C16H20N6O5 — CID 56904317

IUPACN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)c3cc(=O)[nH]c(=O)[nH]3)C2)cc1=O
InChIInChI=1S/C16H20N6O5/c1-21-14(24)6-10(8-18-21)22-4-5-27-11(9-22)2-3-17-15(25)12-7-13(23)20-16(26)19-12/h6-8,11H,2-5,9H2,1H3,(H,17,25)(H2,19,20,23,26)
InChIKeyWVJZNLZHOUGBFJ-UHFFFAOYSA-N
MW376.37 g/mol
LogP-1.82
Rot. Bonds5

About N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide

N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide (PubChem CID 56904317) has the molecular formula C16H20N6O5 and a molecular weight of 376.37 g/mol. Its IUPAC name is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide
PubChem CID56904317
Molecular FormulaC16H20N6O5
Molecular Weight376.37 g/mol
Exact Mass376.15
IUPAC NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)c3cc(=O)[nH]c(=O)[nH]3)C2)cc1=O
InChIInChI=1S/C16H20N6O5/c1-21-14(24)6-10(8-18-21)22-4-5-27-11(9-22)2-3-17-15(25)12-7-13(23)20-16(26)19-12/h6-8,11H,2-5,9H2,1H3,(H,17,25)(H2,19,20,23,26)
InChIKeyWVJZNLZHOUGBFJ-UHFFFAOYSA-N
XLogP-1.82
TPSA142.18 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.37
LogP ≤ 5-1.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide (CID 56904317) is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The canonical SMILES for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide is Cn1ncc(N2CCOC(CCNC(=O)c3cc(=O)[nH]c(=O)[nH]3)C2)cc1=O.
What is the InChIKey of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The InChIKey is WVJZNLZHOUGBFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O5/c1-21-14(24)6-10(8-18-21)22-4-5-27-11(9-22)2-3-17-15(25)12-7-13(23)20-16(26)19-12/h6-8,11H,2-5,9H2,1H3,(H,17,25)(H2,19,20,23,26).
What are the key properties of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide?
N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide has a molecular weight of 376.37 g/mol, XLogP of -1.82, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-2,4-dioxo-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 56904317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).