N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide

C16H25N5O3 — CID 70760345

IUPACN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)N3CCCC3)C2)cc1=O
InChIInChI=1S/C16H25N5O3/c1-19-15(22)10-13(11-18-19)21-8-9-24-14(12-21)4-5-17-16(23)20-6-2-3-7-20/h10-11,14H,2-9,12H2,1H3,(H,17,23)
InChIKeyUGMXZAIMTHPJRH-UHFFFAOYSA-N
MW335.41 g/mol
LogP0.18
Rot. Bonds4

About N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide

N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide (PubChem CID 70760345) has the molecular formula C16H25N5O3 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide
PubChem CID70760345
Molecular FormulaC16H25N5O3
Molecular Weight335.41 g/mol
Exact Mass335.20
IUPAC NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)N3CCCC3)C2)cc1=O
InChIInChI=1S/C16H25N5O3/c1-19-15(22)10-13(11-18-19)21-8-9-24-14(12-21)4-5-17-16(23)20-6-2-3-7-20/h10-11,14H,2-9,12H2,1H3,(H,17,23)
InChIKeyUGMXZAIMTHPJRH-UHFFFAOYSA-N
XLogP0.18
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(tert-butyl)-N'-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}urea
CID 70717227
Propyl {2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}carbamate
CID 70730611
N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}-1-piperidinecarboxamide
CID 70756598
2-[4-[2-(2-aminoethyl)-4-morpholinyl]-6-oxo-1(6H)-pyridazinyl]-N-ethyl-N-methylacetamide
CID 56892429
3,3,3-trifluoro-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}propanamide
CID 56885431
3,3,3-trifluoro-N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]propanamide
CID 95709508
3,3,3-trifluoro-N-[2-[(2S)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]propanamide
CID 95709509
5-[2-(2-Aminoethyl)morpholin-4-yl]-2-(2-ethoxyethyl)pyridazin-3-one
CID 56881771
3-methoxy-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}propanamide
CID 56881900
5-[2-(2-Aminoethyl)morpholin-4-yl]-2-pent-2-ynylpyridazin-3-one
CID 56882486
N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}pentanamide
CID 56901199
2,2-dimethyl-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}butanamide
CID 56903637

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide (CID 70760345) is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide is Cn1ncc(N2CCOC(CCNC(=O)N3CCCC3)C2)cc1=O.
What is the InChIKey of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide?
The InChIKey is UGMXZAIMTHPJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O3/c1-19-15(22)10-13(11-18-19)21-8-9-24-14(12-21)4-5-17-16(23)20-6-2-3-7-20/h10-11,14H,2-9,12H2,1H3,(H,17,23).
What are the key properties of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide?
N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrrolidine-1-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 0.18, 4 rotatable bonds, 1 hydrogen bond donors, and 6 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]pyrrolidine-1-carboxamide is sourced from PubChem (CID 70760345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).