6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine

C20H33N5O — CID 124813844

IUPAC6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine
SMILESCN1C[C@H](COCC2CC2)C2(CCN(c3cc(N(C)C)ncn3)CC2)C1
InChIInChI=1S/C20H33N5O/c1-23(2)18-10-19(22-15-21-18)25-8-6-20(7-9-25)14-24(3)11-17(20)13-26-12-16-4-5-16/h10,15-17H,4-9,11-14H2,1-3H3/t17-/m1/s1
InChIKeyDCPPSZOKGHTUPJ-QGZVFWFLSA-N
MW359.52 g/mol
LogP2.12
Rot. Bonds6

About 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine

6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine (PubChem CID 124813844) has the molecular formula C20H33N5O and a molecular weight of 359.52 g/mol. Its IUPAC name is 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine
PubChem CID124813844
Molecular FormulaC20H33N5O
Molecular Weight359.52 g/mol
Exact Mass359.27
IUPAC Name6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine
SMILESCN1C[C@H](COCC2CC2)C2(CCN(c3cc(N(C)C)ncn3)CC2)C1
InChIInChI=1S/C20H33N5O/c1-23(2)18-10-19(22-15-21-18)25-8-6-20(7-9-25)14-24(3)11-17(20)13-26-12-16-4-5-16/h10,15-17H,4-9,11-14H2,1-3H3/t17-/m1/s1
InChIKeyDCPPSZOKGHTUPJ-QGZVFWFLSA-N
XLogP2.12
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.52
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine
CID 131652378
6-[8-(cyclopropylmethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-N,N-dimethylpyrimidin-4-amine
CID 131658957
6-[(8S)-8-(cyclopropylmethoxymethyl)-5,5-dioxo-5λ6-thia-2-azaspiro[3.4]octan-2-yl]-N,N-dimethylpyrimidin-4-amine
CID 124820006
N,N-dimethyl-6-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 95137548
N,N-dimethyl-6-[4-[(3-methyl-4-pyridinyl)oxymethyl]piperidin-1-yl]pyrimidin-4-amine
CID 163343998
(5S,9R)-9-(cyclopropylmethoxymethyl)-2-cyclopropylsulfonyl-7-methyl-2,7-diazaspiro[4.4]nonane
CID 124814820
1-[4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-2-methoxyethanone
CID 131678283
(3S)-N-(cyclopropylmethyl)-1-[6-(dimethylamino)pyrimidin-4-yl]-3-methylpiperidine-3-carboxamide
CID 124989326
N-(cyclopropylmethyl)-1-[6-(dimethylamino)pyrimidin-4-yl]-3-methylpiperidine-3-carboxamide
CID 110111092
[(5R,9S)-9-(cyclopropylmethoxymethyl)-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl]-(3-methoxy-1,2-oxazol-5-yl)methanone
CID 131681789
N,N-dimethyl-6-[(8S)-8-[2-(oxan-4-ylmethoxy)ethyl]-5-oxa-2-azaspiro[3.4]octan-2-yl]pyrimidin-4-amine
CID 124819679
6-(3-aminopiperidin-1-yl)-N,N-dimethylpyrimidin-4-amine
CID 53185813

Frequently Asked Questions

What is the IUPAC name of 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine?
The IUPAC name of 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine (CID 124813844) is 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine is CN1C[C@H](COCC2CC2)C2(CCN(c3cc(N(C)C)ncn3)CC2)C1.
What is the InChIKey of 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine?
The InChIKey is DCPPSZOKGHTUPJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H33N5O/c1-23(2)18-10-19(22-15-21-18)25-8-6-20(7-9-25)14-24(3)11-17(20)13-26-12-16-4-5-16/h10,15-17H,4-9,11-14H2,1-3H3/t17-/m1/s1.
What are the key properties of 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine?
6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine has a molecular weight of 359.52 g/mol, XLogP of 2.12, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4R)-4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-N,N-dimethylpyrimidin-4-amine is sourced from PubChem (CID 124813844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).