1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine

C14H19N3 — CID 105487025

IUPAC1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1ccc2c(c1)c(CCC1(N)CC1)nn2C
InChIInChI=1S/C14H19N3/c1-10-3-4-13-11(9-10)12(16-17(13)2)5-6-14(15)7-8-14/h3-4,9H,5-8,15H2,1-2H3
InChIKeyDWVLOTSHDYGGAT-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.31
Rot. Bonds3

About 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine

1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine (PubChem CID 105487025) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine
PubChem CID105487025
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCc1ccc2c(c1)c(CCC1(N)CC1)nn2C
InChIInChI=1S/C14H19N3/c1-10-3-4-13-11(9-10)12(16-17(13)2)5-6-14(15)7-8-14/h3-4,9H,5-8,15H2,1-2H3
InChIKeyDWVLOTSHDYGGAT-UHFFFAOYSA-N
XLogP2.31
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1,5-dimethylindazol-3-yl)methyl]-3-azaspiro[5.5]undecan-9-amine;dihydrochloride
CID 154924781
ethyl 4-[(1,5-dimethylindazol-3-yl)methylamino]piperidine-1-carboxylate
CID 50951872
N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 91782573
N-[(1,5-dimethylindazol-3-yl)methyl]-5-methylhex-5-en-2-amine
CID 50976005
N-[(1,5-dimethylindazol-3-yl)methyl]-1-methyl-5-oxo-4H-1,2,4-triazole-3-carboxamide
CID 157017185
N-[(1,5-dimethylindazol-3-yl)methyl]cyclohex-3-ene-1-carboxamide
CID 122563829
1-(cyclopropanecarbonyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide
CID 72852922
4-methyl-2-[(1-methylindazol-3-yl)methylsulfinyl]aniline
CID 81192606
N-[(1,5-dimethylindazol-3-yl)methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 122558835
3-(1,6-dimethylindazol-3-yl)propanoic acid
CID 83910195
(5-fluoro-1-methylindazol-3-yl)methanamine
CID 82600067
3-ethyl-1-methylindazol-5-amine
CID 68609782

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine (CID 105487025) is 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine is Cc1ccc2c(c1)c(CCC1(N)CC1)nn2C.
What is the InChIKey of 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine?
The InChIKey is DWVLOTSHDYGGAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10-3-4-13-11(9-10)12(16-17(13)2)5-6-14(15)7-8-14/h3-4,9H,5-8,15H2,1-2H3.
What are the key properties of 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine?
1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine has a molecular weight of 229.33 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,5-dimethylindazol-3-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105487025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).