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

C15H25N5O2 — CID 96512499

IUPACN-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
SMILESCC(C)NC(=O)CCN1CCO[C@H](CNc2cccnn2)C1
InChIInChI=1S/C15H25N5O2/c1-12(2)18-15(21)5-7-20-8-9-22-13(11-20)10-16-14-4-3-6-17-19-14/h3-4,6,12-13H,5,7-11H2,1-2H3,(H,16,19)(H,18,21)/t13-/m1/s1
InChIKeyMLPCFAKANLZLIF-CYBMUJFWSA-N
MW307.40 g/mol
LogP0.50
Rot. Bonds7

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

N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide (PubChem CID 96512499) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide.

Molecular Properties

Compound NameN-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
PubChem CID96512499
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC NameN-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
SMILESCC(C)NC(=O)CCN1CCO[C@H](CNc2cccnn2)C1
InChIInChI=1S/C15H25N5O2/c1-12(2)18-15(21)5-7-20-8-9-22-13(11-20)10-16-14-4-3-6-17-19-14/h3-4,6,12-13H,5,7-11H2,1-2H3,(H,16,19)(H,18,21)/t13-/m1/s1
InChIKeyMLPCFAKANLZLIF-CYBMUJFWSA-N
XLogP0.50
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[4-(2-methylsulfonylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872271
N-[(1R)-1-(furan-2-yl)ethyl]-2-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]acetamide
CID 96512685
N-[[(2R)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512611
N-[[4-[2-(cyclohexylamino)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872217
1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one
CID 71872215
N-[[(2R)-4-(2-thiophen-2-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512563
2-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 96512525
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-[[4-[(5-methyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872216
(2S)-N-prop-2-enyl-2-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
CID 96512625

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The IUPAC name of N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide (CID 96512499) is N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide.
What is the SMILES notation for N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The canonical SMILES for N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide is CC(C)NC(=O)CCN1CCO[C@H](CNc2cccnn2)C1.
What is the InChIKey of N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
The InChIKey is MLPCFAKANLZLIF-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-12(2)18-15(21)5-7-20-8-9-22-13(11-20)10-16-14-4-3-6-17-19-14/h3-4,6,12-13H,5,7-11H2,1-2H3,(H,16,19)(H,18,21)/t13-/m1/s1.
What are the key properties of N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide?
N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide has a molecular weight of 307.40 g/mol, XLogP of 0.50, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide is sourced from PubChem (CID 96512499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).