(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine

C16H26N4O — CID 164634257

IUPAC(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine
SMILESCc1cc(N2C[C@H](N(C)C)C3(CCOCC3)C2)nc(C)n1
InChIInChI=1S/C16H26N4O/c1-12-9-15(18-13(2)17-12)20-10-14(19(3)4)16(11-20)5-7-21-8-6-16/h9,14H,5-8,10-11H2,1-4H3/t14-/m0/s1
InChIKeyJMYYFLNHUKMAHV-AWEZNQCLSA-N
MW290.41 g/mol
LogP1.64
Rot. Bonds2

About (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine

(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine (PubChem CID 164634257) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine
PubChem CID164634257
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine
SMILESCc1cc(N2C[C@H](N(C)C)C3(CCOCC3)C2)nc(C)n1
InChIInChI=1S/C16H26N4O/c1-12-9-15(18-13(2)17-12)20-10-14(19(3)4)16(11-20)5-7-21-8-6-16/h9,14H,5-8,10-11H2,1-4H3/t14-/m0/s1
InChIKeyJMYYFLNHUKMAHV-AWEZNQCLSA-N
XLogP1.64
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine with MolForge

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Related Compounds

7-(2,5,6-Trimethylpyrimidin-4-yl)-2-oxa-7-azaspiro[4.4]nonane
CID 71969218
4,6-Dimethyl-2-[1-(oxan-4-yl)pyrrolidin-3-yl]pyrimidine
CID 110271060
4-[[(3R)-1-(2,6-dimethylpyrimidin-4-yl)pyrrolidin-3-yl]methyl]morpholine
CID 97575919
4-[[(2R)-1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]morpholine
CID 99714323
(1-{2-[(6-Methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl}piperidin-4-yl)methanol
CID 122566260
N,2-dimethyl-N-(1-methylpiperidin-4-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-4-amine
CID 126429146
2-methyl-4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-6-[(3R)-oxolan-3-yl]pyrimidine
CID 126431696
2-(2-Ethyl-6-methylpyrimidin-4-yl)-8-oxa-2-azaspiro[4.5]decane
CID 126827005
(5S)-2-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-7-oxa-2-azaspiro[4.5]decane
CID 164630642
N,N-dimethyl-2-[(5S)-7-oxa-2-azaspiro[4.5]decan-2-yl]-6-(trifluoromethyl)pyrimidin-4-amine
CID 164632020
N,N-dimethyl-2-(7-oxa-2-azaspiro[4.5]decan-2-yl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 126797743
N,N-dimethyl-2-[4-(oxolan-3-ylmethyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-4-amine
CID 133335960

Frequently Asked Questions

What is the IUPAC name of (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine?
The IUPAC name of (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine (CID 164634257) is (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine is Cc1cc(N2C[C@H](N(C)C)C3(CCOCC3)C2)nc(C)n1.
What is the InChIKey of (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine?
The InChIKey is JMYYFLNHUKMAHV-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-9-15(18-13(2)17-12)20-10-14(19(3)4)16(11-20)5-7-21-8-6-16/h9,14H,5-8,10-11H2,1-4H3/t14-/m0/s1.
What are the key properties of (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine?
(4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine has a molecular weight of 290.41 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethyl-8-oxa-2-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 164634257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).