N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C19H27N5O2 — CID 77091970

IUPACN-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(C)N1CCC2(CCC(CNC(=O)c3cc4ncccn4n3)O2)CC1
InChIInChI=1S/C19H27N5O2/c1-14(2)23-10-6-19(7-11-23)5-4-15(26-19)13-21-18(25)16-12-17-20-8-3-9-24(17)22-16/h3,8-9,12,14-15H,4-7,10-11,13H2,1-2H3,(H,21,25)
InChIKeyZJCCFBXLJQPBQN-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.88
Rot. Bonds4

About N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 77091970) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID77091970
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC NameN-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(C)N1CCC2(CCC(CNC(=O)c3cc4ncccn4n3)O2)CC1
InChIInChI=1S/C19H27N5O2/c1-14(2)23-10-6-19(7-11-23)5-4-15(26-19)13-21-18(25)16-12-17-20-8-3-9-24(17)22-16/h3,8-9,12,14-15H,4-7,10-11,13H2,1-2H3,(H,21,25)
InChIKeyZJCCFBXLJQPBQN-UHFFFAOYSA-N
XLogP1.88
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide with MolForge

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Related Compounds

3-chloro-N-(tetrahydro-2-furanylmethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2983143
US11142526, Example 150
CID 137533096
US9649308, Example 1
CID 122540838
(1-Methylpyrazol-3-yl)-[3-(pyrazin-2-ylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 118740735
6-bromo-N-(tetrahydrofuran-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2978527
N-[cis-octahydro-2H,2'H-3,4'-bipyran-4-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 91766114
N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 74248545
1-(2-methoxyethyl)-N-[(6S)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]pyrazole-3-carboxamide
CID 124621996
[(3S,5S)-3-[(5-fluoropyrimidin-2-yl)amino]-1-oxa-7-azaspiro[4.4]nonan-7-yl]-(1H-pyrazol-5-yl)methanone
CID 97394669
[(3S,5R)-3-[(5-fluoropyrimidin-2-yl)amino]-1-oxa-7-azaspiro[4.4]nonan-7-yl]-(1H-pyrazol-5-yl)methanone
CID 97394670
[(3R,5S)-3-[(5-fluoropyrimidin-2-yl)amino]-1-oxa-7-azaspiro[4.4]nonan-7-yl]-(1H-pyrazol-5-yl)methanone
CID 97394671
[(3R,5R)-3-[(5-fluoropyrimidin-2-yl)amino]-1-oxa-7-azaspiro[4.4]nonan-7-yl]-(1H-pyrazol-5-yl)methanone
CID 97394672

Frequently Asked Questions

What is the IUPAC name of N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 77091970) is N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is CC(C)N1CCC2(CCC(CNC(=O)c3cc4ncccn4n3)O2)CC1.
What is the InChIKey of N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is ZJCCFBXLJQPBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c1-14(2)23-10-6-19(7-11-23)5-4-15(26-19)13-21-18(25)16-12-17-20-8-3-9-24(17)22-16/h3,8-9,12,14-15H,4-7,10-11,13H2,1-2H3,(H,21,25).
What are the key properties of N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-propan-2-yl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 77091970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).