1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide

C19H25N3O2 — CID 141279903

IUPAC1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)NC1CCCc2cc(OC(C)C)ccc21
InChIInChI=1S/C19H25N3O2/c1-12(2)24-15-8-9-16-14(10-15)6-5-7-18(16)20-19(23)17-11-22(4)21-13(17)3/h8-12,18H,5-7H2,1-4H3,(H,20,23)
InChIKeySPKYCQHMVCYSMG-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.32
Rot. Bonds4

About 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide

1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide (PubChem CID 141279903) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
PubChem CID141279903
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)NC1CCCc2cc(OC(C)C)ccc21
InChIInChI=1S/C19H25N3O2/c1-12(2)24-15-8-9-16-14(10-15)6-5-7-18(16)20-19(23)17-11-22(4)21-13(17)3/h8-12,18H,5-7H2,1-4H3,(H,20,23)
InChIKeySPKYCQHMVCYSMG-UHFFFAOYSA-N
XLogP3.32
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-propyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
CID 131898012
N-[6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-3-ethylpyridine-4-carboxamide
CID 75437261
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2,4-dimethylbenzamide
CID 133200269
3-(2,6-difluorophenyl)-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 166973079
4-chloro-2-fluoro-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 97429752
N-[(1R)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 95346205
N-[(1R)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-(4-methylpyrazol-1-yl)acetamide
CID 95346227
3-chloro-N-[(1S)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-4-carboxamide
CID 95905058
N-[(1S)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-methyl-2-oxopyridine-4-carboxamide
CID 94829246
N-[(1R,2R)-2-hydroxycyclohexyl]-1,3-dimethylpyrazole-4-carboxamide
CID 104927400
(2R)-2-amino-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119289450
cis-(1S,2R)-N-[(1R)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide
CID 95346231

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide?
The IUPAC name of 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide (CID 141279903) is 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide is Cc1nn(C)cc1C(=O)NC1CCCc2cc(OC(C)C)ccc21.
What is the InChIKey of 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide?
The InChIKey is SPKYCQHMVCYSMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-12(2)24-15-8-9-16-14(10-15)6-5-7-18(16)20-19(23)17-11-22(4)21-13(17)3/h8-12,18H,5-7H2,1-4H3,(H,20,23).
What are the key properties of 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide?
1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 141279903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).