N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide

C17H22N6O — CID 95744349

IUPACN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide
SMILESCN(C)CCn1cc(NC(=O)CCn2ncc3ccccc32)cn1
InChIInChI=1S/C17H22N6O/c1-21(2)9-10-22-13-15(12-18-22)20-17(24)7-8-23-16-6-4-3-5-14(16)11-19-23/h3-6,11-13H,7-10H2,1-2H3,(H,20,24)
InChIKeyHWWYHMICTRLNBT-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.82
Rot. Bonds7

About N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide

N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide (PubChem CID 95744349) has the molecular formula C17H22N6O and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide
PubChem CID95744349
Molecular FormulaC17H22N6O
Molecular Weight326.40 g/mol
Exact Mass326.19
IUPAC NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide
SMILESCN(C)CCn1cc(NC(=O)CCn2ncc3ccccc32)cn1
InChIInChI=1S/C17H22N6O/c1-21(2)9-10-22-13-15(12-18-22)20-17(24)7-8-23-16-6-4-3-5-14(16)11-19-23/h3-6,11-13H,7-10H2,1-2H3,(H,20,24)
InChIKeyHWWYHMICTRLNBT-UHFFFAOYSA-N
XLogP1.82
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-(4-methylindazol-1-yl)propanamide
CID 95744356
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-(3-methylindazol-1-yl)propanamide
CID 95744353
ethane;2-indazol-1-yl-N,N-dimethylethanamine;propane
CID 145062231
8-bromo-N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]naphthalene-1-carboxamide
CID 167831048
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-2-methylpyrazole-3-carboxamide
CID 95744231
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-2-hydroxy-2-phenylacetamide
CID 111432605
5-(azepan-1-yl)-N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5-oxopentanamide
CID 95744328
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 49087528
4-[(S)-(4-bromophenyl)sulfinyl]-N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]butanamide
CID 96516886
N-(2-indazol-1-ylethyl)-N',N'-dimethylpropane-1,3-diamine
CID 62564894
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 49088305
6-chloro-N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]naphthalene-1-carboxamide
CID 167754395

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide?
The IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide (CID 95744349) is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide.
What is the SMILES notation for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide?
The canonical SMILES for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide is CN(C)CCn1cc(NC(=O)CCn2ncc3ccccc32)cn1.
What is the InChIKey of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide?
The InChIKey is HWWYHMICTRLNBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O/c1-21(2)9-10-22-13-15(12-18-22)20-17(24)7-8-23-16-6-4-3-5-14(16)11-19-23/h3-6,11-13H,7-10H2,1-2H3,(H,20,24).
What are the key properties of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide?
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide has a molecular weight of 326.40 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-3-indazol-1-ylpropanamide is sourced from PubChem (CID 95744349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).