1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine

C12H14N2 — CID 82405741

IUPAC1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine
SMILESCc1ccc2[nH]c(C3(N)CC3)cc2c1
InChIInChI=1S/C12H14N2/c1-8-2-3-10-9(6-8)7-11(14-10)12(13)4-5-12/h2-3,6-7,14H,4-5,13H2,1H3
InChIKeyBHDBXWIWWCMFSS-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.42
Rot. Bonds1

About 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine

1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine (PubChem CID 82405741) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine
PubChem CID82405741
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine
SMILESCc1ccc2[nH]c(C3(N)CC3)cc2c1
InChIInChI=1S/C12H14N2/c1-8-2-3-10-9(6-8)7-11(14-10)12(13)4-5-12/h2-3,6-7,14H,4-5,13H2,1H3
InChIKeyBHDBXWIWWCMFSS-UHFFFAOYSA-N
XLogP2.42
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1H-indol-2-yl)cyclobutan-1-amine
CID 82602362
2-methanidyl-5-methyl-1H-indole;yttrium
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2-[(2R)-aziridin-2-yl]-5-methyl-1H-indole
CID 55263404
2,5-dimethyl-1H-indole;ethane;propane
CID 144992538
1-(6-methylnaphthalen-1-yl)cyclopropan-1-amine
CID 105450867
4-(5-methyl-1H-indol-2-yl)aniline
CID 15322512
N,5-dimethyl-1H-indol-2-amine;dihydrochloride
CID 57435942
5-methyl-2-(trifluoromethyl)-1H-indole
CID 83485208
3-(aminomethyl)-6-methyl-1H-quinolin-2-one
CID 6487618
(1R)-1-(5-methyl-1H-indol-2-yl)prop-2-en-1-amine
CID 131036821
2-(5-methyl-1H-indol-2-yl)ethanol
CID 83674310
3-amino-3-(5-methyl-1H-indol-2-yl)prop-1-en-2-ol
CID 142132542

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine?
The IUPAC name of 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine (CID 82405741) is 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine is Cc1ccc2[nH]c(C3(N)CC3)cc2c1.
What is the InChIKey of 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine?
The InChIKey is BHDBXWIWWCMFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-8-2-3-10-9(6-8)7-11(14-10)12(13)4-5-12/h2-3,6-7,14H,4-5,13H2,1H3.
What are the key properties of 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine?
1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine has a molecular weight of 186.26 g/mol, XLogP of 2.42, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine is sourced from PubChem (CID 82405741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).