N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine

C17H19N3S — CID 60932001

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine
SMILESc1csc(C(Nc2cccc3[nH]ncc23)C2CCCC2)c1
InChIInChI=1S/C17H19N3S/c1-2-6-12(5-1)17(16-9-4-10-21-16)19-14-7-3-8-15-13(14)11-18-20-15/h3-4,7-12,17,19H,1-2,5-6H2,(H,18,20)
InChIKeyPGZMDPOPRCTPAP-UHFFFAOYSA-N
MW297.43 g/mol
LogP4.97
Rot. Bonds4

About N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine

N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine (PubChem CID 60932001) has the molecular formula C17H19N3S and a molecular weight of 297.43 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine
PubChem CID60932001
Molecular FormulaC17H19N3S
Molecular Weight297.43 g/mol
Exact Mass297.13
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine
SMILESc1csc(C(Nc2cccc3[nH]ncc23)C2CCCC2)c1
InChIInChI=1S/C17H19N3S/c1-2-6-12(5-1)17(16-9-4-10-21-16)19-14-7-3-8-15-13(14)11-18-20-15/h3-4,7-12,17,19H,1-2,5-6H2,(H,18,20)
InChIKeyPGZMDPOPRCTPAP-UHFFFAOYSA-N
XLogP4.97
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.43
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-1H-indazol-4-amine
CID 54865782
N-cyclopropyl-1H-indazol-4-amine
CID 103439210
2,6-dichloro-N-[cyclopentyl(thiophen-2-yl)methyl]aniline
CID 65469886
N-[cyclopentyl(thiophen-2-yl)methyl]-2,3,5-trifluoroaniline
CID 63477350
N-[cyclopentyl(thiophen-2-yl)methyl]cyclopropanamine
CID 43754683
N-(3-propan-2-ylcyclobutyl)-1H-indazol-4-amine
CID 103561698
N-[cyclopentyl(thiophen-2-yl)methyl]-2-nitroaniline
CID 43785516
N-[cyclopentyl(thiophen-2-yl)methyl]-4-methylaniline
CID 43765836
[cyclooctyl(thiophen-2-yl)methyl]hydrazine
CID 105255061
N-[1-(1,3-thiazol-2-yl)ethyl]-1H-indazol-4-amine
CID 64992997
2-bromo-N-[cyclopropyl(thiophen-2-yl)methyl]aniline
CID 54982930
3-bromo-N-[cyclopropyl(thiophen-2-yl)methyl]-2-methylaniline
CID 107630101

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine (CID 60932001) is N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine is c1csc(C(Nc2cccc3[nH]ncc23)C2CCCC2)c1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine?
The InChIKey is PGZMDPOPRCTPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3S/c1-2-6-12(5-1)17(16-9-4-10-21-16)19-14-7-3-8-15-13(14)11-18-20-15/h3-4,7-12,17,19H,1-2,5-6H2,(H,18,20).
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine?
N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine has a molecular weight of 297.43 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(thiophen-2-yl)methyl]-1H-indazol-4-amine is sourced from PubChem (CID 60932001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).