N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide

C18H29N5O2 — CID 71872269

IUPACN-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
SMILESO=C(CCN1CCOC(CNc2cccnn2)C1)NC1CCCCC1
InChIInChI=1S/C18H29N5O2/c24-18(21-15-5-2-1-3-6-15)8-10-23-11-12-25-16(14-23)13-19-17-7-4-9-20-22-17/h4,7,9,15-16H,1-3,5-6,8,10-14H2,(H,19,22)(H,21,24)
InChIKeyZLMMIKQLULUOIV-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.43
Rot. Bonds7

About N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide

N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide (PubChem CID 71872269) has the molecular formula C18H29N5O2 and a molecular weight of 347.46 g/mol. Its IUPAC name is N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
PubChem CID71872269
Molecular FormulaC18H29N5O2
Molecular Weight347.46 g/mol
Exact Mass347.23
IUPAC NameN-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
SMILESO=C(CCN1CCOC(CNc2cccnn2)C1)NC1CCCCC1
InChIInChI=1S/C18H29N5O2/c24-18(21-15-5-2-1-3-6-15)8-10-23-11-12-25-16(14-23)13-19-17-7-4-9-20-22-17/h4,7,9,15-16H,1-3,5-6,8,10-14H2,(H,19,22)(H,21,24)
InChIKeyZLMMIKQLULUOIV-UHFFFAOYSA-N
XLogP1.43
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[methyl-(1-pyridazin-3-ylpiperidin-3-yl)amino]-N-(oxan-4-yl)acetamide
CID 53625039
4-Methoxy-1-[4-(pyridazin-3-ylamino)piperidin-1-yl]butan-1-one
CID 56778538
N-(3-methoxypropyl)-2-[methyl-(1-pyridazin-3-ylpiperidin-3-yl)amino]acetamide
CID 56802872
1-Piperidin-1-yl-2-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]ethanone
CID 71872246
N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872248
2,2-dimethyl-N-[3-oxo-3-[4-(pyridazin-3-ylamino)piperidin-1-yl]propyl]propanamide
CID 71878645
1-[4-(Pyridazin-3-ylamino)piperidin-1-yl]-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 75533107
N-(oxan-4-yl)-2-(1-pyridazin-3-ylpiperidin-4-yl)acetamide
CID 95826705
1-[4-[Methyl(pyridazin-3-yl)amino]piperidin-1-yl]-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 56780017
N-[[(2S,4S)-4-fluoro-1-pyridazin-3-ylpyrrolidin-2-yl]methyl]-4-methylmorpholine-2-carboxamide
CID 128989298
N-[[(2S,4S)-4-fluoro-1-pyridazin-3-ylpyrrolidin-2-yl]methyl]-2-morpholin-4-ylacetamide
CID 128995176
(2S)-N-[[(2S,4S)-4-fluoro-1-pyridazin-3-ylpyrrolidin-2-yl]methyl]-4-methylmorpholine-2-carboxamide
CID 129336399

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The IUPAC name of N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide (CID 71872269) is N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The canonical SMILES for N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide is O=C(CCN1CCOC(CNc2cccnn2)C1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The InChIKey is ZLMMIKQLULUOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N5O2/c24-18(21-15-5-2-1-3-6-15)8-10-23-11-12-25-16(14-23)13-19-17-7-4-9-20-22-17/h4,7,9,15-16H,1-3,5-6,8,10-14H2,(H,19,22)(H,21,24).
What are the key properties of N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide has a molecular weight of 347.46 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide is sourced from PubChem (CID 71872269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).