N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine

C16H24N8O — CID 71872591

IUPACN-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
SMILESCCN(CC1CN(Cc2nnnn2C2CC2)CCO1)c1cccnn1
InChIInChI=1S/C16H24N8O/c1-2-23(15-4-3-7-17-18-15)11-14-10-22(8-9-25-14)12-16-19-20-21-24(16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3
InChIKeyXNUBPXMTIJTDHJ-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.53
Rot. Bonds7

About N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine

N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine (PubChem CID 71872591) has the molecular formula C16H24N8O and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
PubChem CID71872591
Molecular FormulaC16H24N8O
Molecular Weight344.42 g/mol
Exact Mass344.21
IUPAC NameN-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
SMILESCCN(CC1CN(Cc2nnnn2C2CC2)CCO1)c1cccnn1
InChIInChI=1S/C16H24N8O/c1-2-23(15-4-3-7-17-18-15)11-14-10-22(8-9-25-14)12-16-19-20-21-24(16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3
InChIKeyXNUBPXMTIJTDHJ-UHFFFAOYSA-N
XLogP0.53
TPSA85.09 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

N-ethyl-N-[[4-(1,2-oxazol-5-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928436
N-[[4-(cyclobutylmethyl)morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
CID 71928433
N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
CID 97028617
N-ethyl-N-[[4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872607
N-ethyl-N-[[(2R)-4-[(5-methylpyrazin-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 97028605
(1S)-2-[(2S)-2-[[ethyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]-1-phenylethanol
CID 100870344
N-ethyl-N-[[4-(2-thiophen-2-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928437
N-ethyl-N-[[(2R)-4-[(1R)-1-pyridin-3-ylethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 98787330
N-[[(2S)-4-[(2-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 96998292
N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 97004851
N-[[4-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 71872633
2-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]acetamide
CID 71872661

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The IUPAC name of N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine (CID 71872591) is N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine.
What is the SMILES notation for N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The canonical SMILES for N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine is CCN(CC1CN(Cc2nnnn2C2CC2)CCO1)c1cccnn1.
What is the InChIKey of N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The InChIKey is XNUBPXMTIJTDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N8O/c1-2-23(15-4-3-7-17-18-15)11-14-10-22(8-9-25-14)12-16-19-20-21-24(16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3.
What are the key properties of N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine has a molecular weight of 344.42 g/mol, XLogP of 0.53, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(1-cyclopropyltetrazol-5-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine is sourced from PubChem (CID 71872591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).