(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane

C16H26N4 — CID 97484147

IUPAC(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane
SMILESCCCN1CC[C@]2(CCCN(c3ccc(C)nn3)C2)C1
InChIInChI=1S/C16H26N4/c1-3-9-19-11-8-16(12-19)7-4-10-20(13-16)15-6-5-14(2)17-18-15/h5-6H,3-4,7-13H2,1-2H3/t16-/m1/s1
InChIKeyUSTDXZPJMGVJAQ-MRXNPFEDSA-N
MW274.41 g/mol
LogP2.49
Rot. Bonds3

About (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane

(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane (PubChem CID 97484147) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane
PubChem CID97484147
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane
SMILESCCCN1CC[C@]2(CCCN(c3ccc(C)nn3)C2)C1
InChIInChI=1S/C16H26N4/c1-3-9-19-11-8-16(12-19)7-4-10-20(13-16)15-6-5-14(2)17-18-15/h5-6H,3-4,7-13H2,1-2H3/t16-/m1/s1
InChIKeyUSTDXZPJMGVJAQ-MRXNPFEDSA-N
XLogP2.49
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5S)-9-(6-methylpyridazin-3-yl)-2-pyrimidin-2-yl-2,9-diazaspiro[4.5]decane
CID 97484053
11-methyl-2-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 134072674
(6S)-2-(2-methoxyethyl)-8-(6-methylpyridazin-3-yl)-2,8-diazaspiro[5.5]undecan-3-one
CID 96580750
9-ethyl-2-propyl-2,9-diazaspiro[4.5]decane
CID 129100662
[4-(dimethylamino)phenyl]-[9-(6-methylpyridazin-3-yl)-2,9-diazaspiro[4.5]decan-2-yl]methanone
CID 131663457
2-(6-methylpyridazin-3-yl)-11-(pyridin-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 131640700
(6S)-2-ethylsulfonyl-11-(6-methylpyridazin-3-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 97494848
(6R)-8-(6-methylpyridazin-3-yl)-2-(pyridin-3-ylmethyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 95870283
7-[(3-methylphenyl)methyl]-2-propyl-2,7-diazaspiro[4.5]decane
CID 45236934
(5S)-9-(6-methylpyridazin-3-yl)-1-prop-2-enyl-1,9-diazaspiro[4.5]decane
CID 97393463
3-(6-methylpyridazin-3-yl)-9-(pyridin-4-ylmethyl)-3,9-diazaspiro[5.5]undecane
CID 97385532
9-(6-methylpyridazin-3-yl)-2,9-diazaspiro[4.5]decan-1-one
CID 131649510

Frequently Asked Questions

What is the IUPAC name of (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane?
The IUPAC name of (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane (CID 97484147) is (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane.
What is the SMILES notation for (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane?
The canonical SMILES for (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane is CCCN1CC[C@]2(CCCN(c3ccc(C)nn3)C2)C1.
What is the InChIKey of (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane?
The InChIKey is USTDXZPJMGVJAQ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H26N4/c1-3-9-19-11-8-16(12-19)7-4-10-20(13-16)15-6-5-14(2)17-18-15/h5-6H,3-4,7-13H2,1-2H3/t16-/m1/s1.
What are the key properties of (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane?
(5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane has a molecular weight of 274.41 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-7-(6-methylpyridazin-3-yl)-2-propyl-2,7-diazaspiro[4.5]decane is sourced from PubChem (CID 97484147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).