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

C13H15N5 — CID 55064680

IUPACN-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine
SMILESCCn1ccnc1CNc1cccc2[nH]ncc12
InChIInChI=1S/C13H15N5/c1-2-18-7-6-14-13(18)9-15-11-4-3-5-12-10(11)8-16-17-12/h3-8,15H,2,9H2,1H3,(H,16,17)
InChIKeyFCHBQJHXMQRGKD-UHFFFAOYSA-N
MW241.30 g/mol
LogP2.39
Rot. Bonds4

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

N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine (PubChem CID 55064680) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine.

Molecular Properties

Compound NameN-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine
PubChem CID55064680
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC NameN-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine
SMILESCCn1ccnc1CNc1cccc2[nH]ncc12
InChIInChI=1S/C13H15N5/c1-2-18-7-6-14-13(18)9-15-11-4-3-5-12-10(11)8-16-17-12/h3-8,15H,2,9H2,1H3,(H,16,17)
InChIKeyFCHBQJHXMQRGKD-UHFFFAOYSA-N
XLogP2.39
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylimidazol-2-yl)methyl]-2-methylpyridin-3-amine
CID 79041847
2-bromo-3-chloro-N-[(1-ethylimidazol-2-yl)methyl]aniline
CID 103478138
N-[(1-ethylimidazol-2-yl)methyl]-2-methylquinolin-8-amine
CID 62954974
N-[(1-ethylimidazol-2-yl)methyl]-2-imidazol-1-ylaniline
CID 62355714
2-chloro-N-[(1-ethylimidazol-2-yl)methyl]-5-fluoroaniline
CID 113255916
N-[(3-methylthiophen-2-yl)methyl]-1H-indazol-4-amine
CID 54865666
2-chloro-N-[(1-ethylimidazol-2-yl)methyl]-4-iodoaniline
CID 55064679
3-N-[(1-ethylimidazol-2-yl)methyl]-4-N,4-N-dimethylpyridine-3,4-diamine
CID 62355893
2-[(1-ethylimidazol-2-yl)methylamino]-N,N-dimethylbenzamide
CID 62351342
3-ethyl-N-[(1-ethylimidazol-2-yl)methyl]aniline
CID 62356031
N-(thiadiazol-4-ylmethyl)-1H-indazol-4-amine
CID 60931620
N-[2-[(1H-indazol-4-ylamino)methyl]phenyl]acetamide
CID 66418442

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine?
The IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine (CID 55064680) is N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine.
What is the SMILES notation for N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine?
The canonical SMILES for N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine is CCn1ccnc1CNc1cccc2[nH]ncc12.
What is the InChIKey of N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine?
The InChIKey is FCHBQJHXMQRGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-2-18-7-6-14-13(18)9-15-11-4-3-5-12-10(11)8-16-17-12/h3-8,15H,2,9H2,1H3,(H,16,17).
What are the key properties of N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine?
N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine has a molecular weight of 241.30 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylimidazol-2-yl)methyl]-1H-indazol-4-amine is sourced from PubChem (CID 55064680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).