4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine

C19H33N5O — CID 95717606

IUPAC4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine
SMILESCOCCN1CCC[C@@]2(CCN(c3nc(N(C)C)nc(C)c3C)C2)C1
InChIInChI=1S/C19H33N5O/c1-15-16(2)20-18(22(3)4)21-17(15)24-10-8-19(14-24)7-6-9-23(13-19)11-12-25-5/h6-14H2,1-5H3/t19-/m1/s1
InChIKeyMZGLTNQQAFPGJS-LJQANCHMSA-N
MW347.51 g/mol
LogP2.10
Rot. Bonds5

About 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine

4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine (PubChem CID 95717606) has the molecular formula C19H33N5O and a molecular weight of 347.51 g/mol. Its IUPAC name is 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine
PubChem CID95717606
Molecular FormulaC19H33N5O
Molecular Weight347.51 g/mol
Exact Mass347.27
IUPAC Name4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine
SMILESCOCCN1CCC[C@@]2(CCN(c3nc(N(C)C)nc(C)c3C)C2)C1
InChIInChI=1S/C19H33N5O/c1-15-16(2)20-18(22(3)4)21-17(15)24-10-8-19(14-24)7-6-9-23(13-19)11-12-25-5/h6-14H2,1-5H3/t19-/m1/s1
InChIKeyMZGLTNQQAFPGJS-LJQANCHMSA-N
XLogP2.10
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.51
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine?
The IUPAC name of 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine (CID 95717606) is 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine.
What is the SMILES notation for 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine?
The canonical SMILES for 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine is COCCN1CCC[C@@]2(CCN(c3nc(N(C)C)nc(C)c3C)C2)C1.
What is the InChIKey of 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine?
The InChIKey is MZGLTNQQAFPGJS-LJQANCHMSA-N. The full InChI is InChI=1S/C19H33N5O/c1-15-16(2)20-18(22(3)4)21-17(15)24-10-8-19(14-24)7-6-9-23(13-19)11-12-25-5/h6-14H2,1-5H3/t19-/m1/s1.
What are the key properties of 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine?
4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine has a molecular weight of 347.51 g/mol, XLogP of 2.10, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5R)-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decan-2-yl]-N,N,5,6-tetramethylpyrimidin-2-amine is sourced from PubChem (CID 95717606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).