N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine

C18H25N5O — CID 98787330

IUPACN-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCCN(C[C@H]1CN([C@H](C)c2cccnc2)CCO1)c1cccnn1
InChIInChI=1S/C18H25N5O/c1-3-22(18-7-5-9-20-21-18)13-17-14-23(10-11-24-17)15(2)16-6-4-8-19-12-16/h4-9,12,15,17H,3,10-11,13-14H2,1-2H3/t15-,17+/m1/s1
InChIKeyADEJLMUQJHOAAP-WBVHZDCISA-N
MW327.43 g/mol
LogP2.16
Rot. Bonds6

About N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine

N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 98787330) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID98787330
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC NameN-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCCN(C[C@H]1CN([C@H](C)c2cccnc2)CCO1)c1cccnn1
InChIInChI=1S/C18H25N5O/c1-3-22(18-7-5-9-20-21-18)13-17-14-23(10-11-24-17)15(2)16-6-4-8-19-12-16/h4-9,12,15,17H,3,10-11,13-14H2,1-2H3/t15-,17+/m1/s1
InChIKeyADEJLMUQJHOAAP-WBVHZDCISA-N
XLogP2.16
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 98787330) is N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine is CCN(C[C@H]1CN([C@H](C)c2cccnc2)CCO1)c1cccnn1.
What is the InChIKey of N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is ADEJLMUQJHOAAP-WBVHZDCISA-N. The full InChI is InChI=1S/C18H25N5O/c1-3-22(18-7-5-9-20-21-18)13-17-14-23(10-11-24-17)15(2)16-6-4-8-19-12-16/h4-9,12,15,17H,3,10-11,13-14H2,1-2H3/t15-,17+/m1/s1.
What are the key properties of N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 327.43 g/mol, XLogP of 2.16, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 98787330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).