[1-(1-methylindol-3-yl)cyclopropyl]methanamine

C13H16N2 — CID 82278323

IUPAC[1-(1-methylindol-3-yl)cyclopropyl]methanamine
SMILESCn1cc(C2(CN)CC2)c2ccccc21
InChIInChI=1S/C13H16N2/c1-15-8-11(13(9-14)6-7-13)10-4-2-3-5-12(10)15/h2-5,8H,6-7,9,14H2,1H3
InChIKeyRVTRTCYHYYNYLP-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.17
Rot. Bonds2

About [1-(1-methylindol-3-yl)cyclopropyl]methanamine

[1-(1-methylindol-3-yl)cyclopropyl]methanamine (PubChem CID 82278323) has the molecular formula C13H16N2 and a molecular weight of 200.28 g/mol. Its IUPAC name is [1-(1-methylindol-3-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(1-methylindol-3-yl)cyclopropyl]methanamine
PubChem CID82278323
Molecular FormulaC13H16N2
Molecular Weight200.28 g/mol
Exact Mass200.13
IUPAC Name[1-(1-methylindol-3-yl)cyclopropyl]methanamine
SMILESCn1cc(C2(CN)CC2)c2ccccc21
InChIInChI=1S/C13H16N2/c1-15-8-11(13(9-14)6-7-13)10-4-2-3-5-12(10)15/h2-5,8H,6-7,9,14H2,1H3
InChIKeyRVTRTCYHYYNYLP-UHFFFAOYSA-N
XLogP2.17
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(5-fluoro-1-methylindol-3-yl)cyclopropyl]methanamine
CID 82278328
[1-(7-chloro-1-methylindol-3-yl)cyclopropyl]methanamine
CID 82278339
[1-(1-methyl-7-propan-2-ylindol-3-yl)cyclopropyl]methanamine
CID 82278337
2-[1-(1-methylindol-3-yl)cyclopentyl]acetonitrile
CID 10752435
2-[1-(1-methylindol-3-yl)cyclopropyl]propan-2-amine
CID 83673846
N-[[1-(1-methylindol-3-yl)cyclopropyl]methyl]propane-1-sulfonamide
CID 113084974
[1-(5-ethyl-1-methylindol-3-yl)cyclopentyl]methanamine
CID 82278342
1-[3-(1-methylindol-3-yl)oxetan-3-yl]propan-2-amine
CID 116869840
1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
CID 154503524
3-[1-(aminomethyl)cyclopentyl]-1-methylindol-4-ol
CID 82664685
[1-(5-methyl-[1,3]dioxolo[4,5-f]indol-7-yl)cyclopropyl]methanamine
CID 82497562
2-[3-(1-methylindol-3-yl)oxetan-3-yl]ethanethiol
CID 116872556

Frequently Asked Questions

What is the IUPAC name of [1-(1-methylindol-3-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(1-methylindol-3-yl)cyclopropyl]methanamine (CID 82278323) is [1-(1-methylindol-3-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(1-methylindol-3-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(1-methylindol-3-yl)cyclopropyl]methanamine is Cn1cc(C2(CN)CC2)c2ccccc21.
What is the InChIKey of [1-(1-methylindol-3-yl)cyclopropyl]methanamine?
The InChIKey is RVTRTCYHYYNYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-15-8-11(13(9-14)6-7-13)10-4-2-3-5-12(10)15/h2-5,8H,6-7,9,14H2,1H3.
What are the key properties of [1-(1-methylindol-3-yl)cyclopropyl]methanamine?
[1-(1-methylindol-3-yl)cyclopropyl]methanamine has a molecular weight of 200.28 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylindol-3-yl)cyclopropyl]methanamine is sourced from PubChem (CID 82278323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).