N-(1-phenylpentyl)-1H-indazol-7-amine

C18H21N3 — CID 43788123

IUPACN-(1-phenylpentyl)-1H-indazol-7-amine
SMILESCCCCC(Nc1cccc2cn[nH]c12)c1ccccc1
InChIInChI=1S/C18H21N3/c1-2-3-11-16(14-8-5-4-6-9-14)20-17-12-7-10-15-13-19-21-18(15)17/h4-10,12-13,16,20H,2-3,11H2,1H3,(H,19,21)
InChIKeyQTNUIGYKCWPNCT-UHFFFAOYSA-N
MW279.39 g/mol
LogP4.91
Rot. Bonds6

About N-(1-phenylpentyl)-1H-indazol-7-amine

N-(1-phenylpentyl)-1H-indazol-7-amine (PubChem CID 43788123) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is N-(1-phenylpentyl)-1H-indazol-7-amine.

Molecular Properties

Compound NameN-(1-phenylpentyl)-1H-indazol-7-amine
PubChem CID43788123
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC NameN-(1-phenylpentyl)-1H-indazol-7-amine
SMILESCCCCC(Nc1cccc2cn[nH]c12)c1ccccc1
InChIInChI=1S/C18H21N3/c1-2-3-11-16(14-8-5-4-6-9-14)20-17-12-7-10-15-13-19-21-18(15)17/h4-10,12-13,16,20H,2-3,11H2,1H3,(H,19,21)
InChIKeyQTNUIGYKCWPNCT-UHFFFAOYSA-N
XLogP4.91
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-1H-indazol-7-amine
CID 43730948
2-fluoro-N-(1-phenylpentyl)aniline
CID 43763346
3-fluoro-2-methyl-N-(1-phenylpentyl)aniline
CID 63453826
2-N,2-N-dimethyl-1-N-(1-phenylpentyl)benzene-1,2-diamine
CID 43787294
N-[(2R)-4-methylpentan-2-yl]-1H-indazol-7-amine
CID 93272922
2-methylsulfanyl-N-(1-phenylhexyl)aniline
CID 43780995
N-(1-phenylpentyl)aniline;hydrochloride
CID 44887283
4-chloro-N-(1-phenylhexyl)pyridin-3-amine
CID 83166461
N-(2-ethylbutyl)-1H-indazol-7-amine
CID 43730884
N-(2-methylpropyl)-1H-indazol-7-amine
CID 43730878
N-benzyl-1H-indazol-7-amine
CID 43730923
N-[1-(2-fluorophenyl)ethyl]-1H-indazol-7-amine
CID 43730981

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpentyl)-1H-indazol-7-amine?
The IUPAC name of N-(1-phenylpentyl)-1H-indazol-7-amine (CID 43788123) is N-(1-phenylpentyl)-1H-indazol-7-amine.
What is the SMILES notation for N-(1-phenylpentyl)-1H-indazol-7-amine?
The canonical SMILES for N-(1-phenylpentyl)-1H-indazol-7-amine is CCCCC(Nc1cccc2cn[nH]c12)c1ccccc1.
What is the InChIKey of N-(1-phenylpentyl)-1H-indazol-7-amine?
The InChIKey is QTNUIGYKCWPNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-2-3-11-16(14-8-5-4-6-9-14)20-17-12-7-10-15-13-19-21-18(15)17/h4-10,12-13,16,20H,2-3,11H2,1H3,(H,19,21).
What are the key properties of N-(1-phenylpentyl)-1H-indazol-7-amine?
N-(1-phenylpentyl)-1H-indazol-7-amine has a molecular weight of 279.39 g/mol, XLogP of 4.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpentyl)-1H-indazol-7-amine is sourced from PubChem (CID 43788123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).