3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide

C15H24N4O — CID 130284394

IUPAC3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide
SMILESC[C@@H]1CC2(CCCC2)CC[C@H]1n1cc(C(N)=O)c(N)n1
InChIInChI=1S/C15H24N4O/c1-10-8-15(5-2-3-6-15)7-4-12(10)19-9-11(14(17)20)13(16)18-19/h9-10,12H,2-8H2,1H3,(H2,16,18)(H2,17,20)/t10-,12-/m1/s1
InChIKeyPGQIJMMIVPENJU-ZYHUDNBSSA-N
MW276.38 g/mol
LogP2.49
Rot. Bonds2

About 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide

3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide (PubChem CID 130284394) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide
PubChem CID130284394
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide
SMILESC[C@@H]1CC2(CCCC2)CC[C@H]1n1cc(C(N)=O)c(N)n1
InChIInChI=1S/C15H24N4O/c1-10-8-15(5-2-3-6-15)7-4-12(10)19-9-11(14(17)20)13(16)18-19/h9-10,12H,2-8H2,1H3,(H2,16,18)(H2,17,20)/t10-,12-/m1/s1
InChIKeyPGQIJMMIVPENJU-ZYHUDNBSSA-N
XLogP2.49
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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tert-butyl 4-(3-amino-4-carbamoylpyrazol-1-yl)piperidine-1-carboxylate
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3-(4-chloro-3-fluoroanilino)-1-[(1S,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide
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1-[(1S,2S,4S)-2-amino-4-hydroxy-4-methylcyclohexyl]-3-(4-chloroanilino)pyrazole-4-carboxamide
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3-anilino-1-[(1S,2R,3S)-3-hydroxy-2-methylcyclohexyl]pyrazole-4-carboxamide
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1-[4-(azetidin-1-yl)-2-methylcyclohexyl]-3-(4-formylanilino)pyrazole-4-carboxamide
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ethyl 3-amino-1-cyclopentylpyrazole-4-carboxylate
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1-[(1S,2S)-2-methylcyclohexyl]-3-[[6-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]-3-pyridinyl]amino]pyrazole-4-carboxamide
CID 130284629
(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone
CID 146680609
[[2-[3-[(6-amino-5-methyl-3-pyridinyl)amino]-4-carbamoylpyrazol-1-yl]cyclohexyl]amino]methyl 5-[[1-(2-amino-2-methylcyclohexyl)-4-carbamoylpyrazol-3-yl]amino]-3-methylpyridine-2-carboxylate
CID 123576178
1-[(1S,2S,4S)-4-[tert-butyl(methyl)amino]-2-methylcyclohexyl]-3-(4-chloroanilino)pyrazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide?
The IUPAC name of 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide (CID 130284394) is 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide?
The canonical SMILES for 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide is C[C@@H]1CC2(CCCC2)CC[C@H]1n1cc(C(N)=O)c(N)n1.
What is the InChIKey of 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide?
The InChIKey is PGQIJMMIVPENJU-ZYHUDNBSSA-N. The full InChI is InChI=1S/C15H24N4O/c1-10-8-15(5-2-3-6-15)7-4-12(10)19-9-11(14(17)20)13(16)18-19/h9-10,12H,2-8H2,1H3,(H2,16,18)(H2,17,20)/t10-,12-/m1/s1.
What are the key properties of 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide?
3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[(8R,9R)-9-methylspiro[4.5]decan-8-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 130284394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).