1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine

C15H22N2 — CID 115105609

IUPAC1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine
SMILESCC(N)c1cccc2c1N(CC1CCC1)CC2
InChIInChI=1S/C15H22N2/c1-11(16)14-7-3-6-13-8-9-17(15(13)14)10-12-4-2-5-12/h3,6-7,11-12H,2,4-5,8-10,16H2,1H3
InChIKeyFAVHGINVRHQGCR-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.87
Rot. Bonds3

About 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine

1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine (PubChem CID 115105609) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine
PubChem CID115105609
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC Name1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine
SMILESCC(N)c1cccc2c1N(CC1CCC1)CC2
InChIInChI=1S/C15H22N2/c1-11(16)14-7-3-6-13-8-9-17(15(13)14)10-12-4-2-5-12/h3,6-7,11-12H,2,4-5,8-10,16H2,1H3
InChIKeyFAVHGINVRHQGCR-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]methanamine
CID 115105607
2-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]propan-2-amine
CID 117118853
1-(cyclobutylmethyl)-2,3-dihydroindole-7-carbaldehyde
CID 115105685
[1-(cyclopropylmethyl)-2,3-dihydroindol-7-yl]methanamine
CID 115105603
1-[1-(cyclohexylmethyl)-2,3-dihydroindol-5-yl]ethanamine
CID 102661602
3-[1-(cyclopropylmethyl)-2,3-dihydroindol-7-yl]-2-methylpropanoic acid
CID 115105719
1-[1-(cyclobutylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine
CID 115106081
2-(1-cyclohexyl-2,3-dihydroindol-7-yl)propan-1-amine
CID 117118520
8-bromo-1-(cyclopropylmethyl)-3,4-dihydro-2H-quinoline
CID 84738520
1-[1-(oxan-4-ylmethyl)-2,3-dihydroindol-7-yl]ethanone
CID 115105692
2-(1-cyclobutyl-2,3-dihydroindol-7-yl)propan-1-ol
CID 115115125
(2R)-2-amino-1-[4-(2,3-dihydroindol-1-ylmethyl)piperidin-1-yl]propan-1-one
CID 119861404

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine?
The IUPAC name of 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine (CID 115105609) is 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine.
What is the SMILES notation for 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine?
The canonical SMILES for 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine is CC(N)c1cccc2c1N(CC1CCC1)CC2.
What is the InChIKey of 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine?
The InChIKey is FAVHGINVRHQGCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-11(16)14-7-3-6-13-8-9-17(15(13)14)10-12-4-2-5-12/h3,6-7,11-12H,2,4-5,8-10,16H2,1H3.
What are the key properties of 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine?
1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine has a molecular weight of 230.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclobutylmethyl)-2,3-dihydroindol-7-yl]ethanamine is sourced from PubChem (CID 115105609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).