N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine

C17H25N3 — CID 104747505

IUPACN-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine
SMILESCCCNC(Cn1ncc2ccccc21)C1CCCC1
InChIInChI=1S/C17H25N3/c1-2-11-18-16(14-7-3-4-8-14)13-20-17-10-6-5-9-15(17)12-19-20/h5-6,9-10,12,14,16,18H,2-4,7-8,11,13H2,1H3
InChIKeyVPXIOAAHJREUSZ-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.59
Rot. Bonds6

About N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine

N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine (PubChem CID 104747505) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine
PubChem CID104747505
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC NameN-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine
SMILESCCCNC(Cn1ncc2ccccc21)C1CCCC1
InChIInChI=1S/C17H25N3/c1-2-11-18-16(14-7-3-4-8-14)13-20-17-10-6-5-9-15(17)12-19-20/h5-6,9-10,12,14,16,18H,2-4,7-8,11,13H2,1H3
InChIKeyVPXIOAAHJREUSZ-UHFFFAOYSA-N
XLogP3.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(indazol-1-ylmethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62446589
1-[(3-propan-2-ylcyclohexyl)methyl]indazole
CID 171430317
1-propylindazole
CID 18695497
1-[2-cyclopentyl-2-(propylamino)ethyl]azepane-2,7-dione
CID 104747332
N-[1-cyclopentyl-2-(2-ethoxyphenoxy)ethyl]propan-1-amine
CID 104748399
1-indazol-1-yl-3,3-dimethylbutan-2-ol
CID 62141901
2-[2-cyclopropyl-2-(propylamino)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 63913073
N-[1-cyclohexyl-2-(1-methylpyrazol-4-yl)ethyl]propan-1-amine
CID 62126447
1-cyclohexyl-N'-ethyl-N'-phenyl-N-propylethane-1,2-diamine
CID 104744455
1-[2-cyclopentyl-2-(propylamino)ethyl]-4,6-dimethylpyrimidin-2-one
CID 104747038
N-[1-cyclohexyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethyl]propan-1-amine
CID 104748080
1-ethylindazole;propane
CID 143188130

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine?
The IUPAC name of N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine (CID 104747505) is N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine.
What is the SMILES notation for N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine?
The canonical SMILES for N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine is CCCNC(Cn1ncc2ccccc21)C1CCCC1.
What is the InChIKey of N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine?
The InChIKey is VPXIOAAHJREUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-2-11-18-16(14-7-3-4-8-14)13-20-17-10-6-5-9-15(17)12-19-20/h5-6,9-10,12,14,16,18H,2-4,7-8,11,13H2,1H3.
What are the key properties of N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine?
N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine has a molecular weight of 271.41 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-2-indazol-1-ylethyl)propan-1-amine is sourced from PubChem (CID 104747505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).