1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one

C16H25N5O2 — CID 71872215

IUPAC1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one
SMILESO=C1CCCN1CCCN1CCOC(CNc2cccnn2)C1
InChIInChI=1S/C16H25N5O2/c22-16-5-2-8-21(16)9-3-7-20-10-11-23-14(13-20)12-17-15-4-1-6-18-19-15/h1,4,6,14H,2-3,5,7-13H2,(H,17,19)
InChIKeyYFSLPNLKDKKUNO-UHFFFAOYSA-N
MW319.41 g/mol
LogP0.60
Rot. Bonds7

About 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one

1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one (PubChem CID 71872215) has the molecular formula C16H25N5O2 and a molecular weight of 319.41 g/mol. Its IUPAC name is 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one
PubChem CID71872215
Molecular FormulaC16H25N5O2
Molecular Weight319.41 g/mol
Exact Mass319.20
IUPAC Name1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one
SMILESO=C1CCCN1CCCN1CCOC(CNc2cccnn2)C1
InChIInChI=1S/C16H25N5O2/c22-16-5-2-8-21(16)9-3-7-20-10-11-23-14(13-20)12-17-15-4-1-6-18-19-15/h1,4,6,14H,2-3,5,7-13H2,(H,17,19)
InChIKeyYFSLPNLKDKKUNO-UHFFFAOYSA-N
XLogP0.60
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[4-[2-(cyclohexylamino)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872217
N-[[4-(2-methylsulfonylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872271
N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
CID 96512499
N-[[(2R)-4-(2-thiophen-2-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512563
N-[[(2R)-4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512573
N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928034
N-[[(2R)-4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512555
N-[[(2S)-4-(1,2-oxazol-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512678
(3R)-3-[(2S)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]oxolan-2-one
CID 96512670
N-[[4-(oxolan-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872272
N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928020
(2S)-2-[[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]methyl]pentanedinitrile
CID 98775216

Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one?
The IUPAC name of 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one (CID 71872215) is 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one?
The canonical SMILES for 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one is O=C1CCCN1CCCN1CCOC(CNc2cccnn2)C1.
What is the InChIKey of 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one?
The InChIKey is YFSLPNLKDKKUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O2/c22-16-5-2-8-21(16)9-3-7-20-10-11-23-14(13-20)12-17-15-4-1-6-18-19-15/h1,4,6,14H,2-3,5,7-13H2,(H,17,19).
What are the key properties of 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one?
1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one has a molecular weight of 319.41 g/mol, XLogP of 0.60, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one is sourced from PubChem (CID 71872215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).