N-(1H-indazol-7-ylmethyl)cyclopropanamine

C11H13N3 — CID 115678445

IUPACN-(1H-indazol-7-ylmethyl)cyclopropanamine
SMILESc1cc(CNC2CC2)c2[nH]ncc2c1
InChIInChI=1S/C11H13N3/c1-2-8(6-12-10-4-5-10)11-9(3-1)7-13-14-11/h1-3,7,10,12H,4-6H2,(H,13,14)
InChIKeyIHEXURUCLCTLRG-UHFFFAOYSA-N
MW187.25 g/mol
LogP1.81
Rot. Bonds3

About N-(1H-indazol-7-ylmethyl)cyclopropanamine

N-(1H-indazol-7-ylmethyl)cyclopropanamine (PubChem CID 115678445) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N-(1H-indazol-7-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(1H-indazol-7-ylmethyl)cyclopropanamine
PubChem CID115678445
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN-(1H-indazol-7-ylmethyl)cyclopropanamine
SMILESc1cc(CNC2CC2)c2[nH]ncc2c1
InChIInChI=1S/C11H13N3/c1-2-8(6-12-10-4-5-10)11-9(3-1)7-13-14-11/h1-3,7,10,12H,4-6H2,(H,13,14)
InChIKeyIHEXURUCLCTLRG-UHFFFAOYSA-N
XLogP1.81
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indazol-7-ylmethyl)oxolan-3-amine
CID 115910621
N-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]cyclopropanamine
CID 79490409
N-cyclopropyl-N-[[4-(1H-indazol-7-ylmethylamino)phenyl]methyl]acetamide
CID 71913375
N-(isoquinolin-5-ylmethyl)cyclopropanamine
CID 58170897
2-[(1H-indazol-7-ylmethylamino)methyl]-2-methylcyclohexan-1-ol
CID 111969476
7-(2-methylpropyl)-1H-indazole
CID 167194868
1-(4-chlorophenyl)-2-(1H-indazol-7-ylmethylamino)ethanol
CID 111969339
N-(1H-indazol-7-ylmethyl)-N-methylhydroxylamine
CID 96741733
2-[1-(1H-indazol-7-ylmethyl)piperidin-4-yl]-2-methylpropanoic acid
CID 167919240
N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
CID 71974601
N-[[5-(2-bromophenyl)-1H-pyrazol-4-yl]methyl]cyclopropanamine
CID 79485095
7-[(3-piperazin-1-ylpyrrolidin-1-yl)methyl]-1H-indazole
CID 120968620

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-7-ylmethyl)cyclopropanamine?
The IUPAC name of N-(1H-indazol-7-ylmethyl)cyclopropanamine (CID 115678445) is N-(1H-indazol-7-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(1H-indazol-7-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(1H-indazol-7-ylmethyl)cyclopropanamine is c1cc(CNC2CC2)c2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-7-ylmethyl)cyclopropanamine?
The InChIKey is IHEXURUCLCTLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-8(6-12-10-4-5-10)11-9(3-1)7-13-14-11/h1-3,7,10,12H,4-6H2,(H,13,14).
What are the key properties of N-(1H-indazol-7-ylmethyl)cyclopropanamine?
N-(1H-indazol-7-ylmethyl)cyclopropanamine has a molecular weight of 187.25 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-7-ylmethyl)cyclopropanamine is sourced from PubChem (CID 115678445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).