[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine

C17H25N — CID 117360942

IUPAC[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine
SMILESCC1CCc2ccc(C3(CN)CCCCC3)cc21
InChIInChI=1S/C17H25N/c1-13-5-6-14-7-8-15(11-16(13)14)17(12-18)9-3-2-4-10-17/h7-8,11,13H,2-6,9-10,12,18H2,1H3
InChIKeyGUCMXZBECKVDKW-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.90
Rot. Bonds2

About [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine

[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine (PubChem CID 117360942) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine
PubChem CID117360942
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine
SMILESCC1CCc2ccc(C3(CN)CCCCC3)cc21
InChIInChI=1S/C17H25N/c1-13-5-6-14-7-8-15(11-16(13)14)17(12-18)9-3-2-4-10-17/h7-8,11,13H,2-6,9-10,12,18H2,1H3
InChIKeyGUCMXZBECKVDKW-UHFFFAOYSA-N
XLogP3.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol
CID 117281201
[1-(2,2-dimethyl-3H-1-benzofuran-6-yl)cyclohexyl]methanamine
CID 117402987
[1-(1-methyl-2,3-dihydroindol-6-yl)cyclohexyl]methanamine
CID 117363408
[1-(3,4-dimethylphenyl)cyclohexyl]methanamine
CID 62899225
[1-(3-chloro-4-methylphenyl)cyclohexyl]methanamine
CID 83824553
(8R)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 57293578
[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine
CID 117488616
[1-(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)cyclohexyl]methanamine
CID 117436747
4-[1-(aminomethyl)cyclohexyl]benzenethiol
CID 154826557
[1-(4-chlorophenyl)cycloheptyl]methanamine
CID 28937852
7-(1-isocyanatocyclopropyl)-1-methyl-1,2,3,4-tetrahydronaphthalene
CID 117327361
5-[1-(aminomethyl)cyclohexyl]-1,3-dihydroindol-2-one
CID 82497597

Frequently Asked Questions

What is the IUPAC name of [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine (CID 117360942) is [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine is CC1CCc2ccc(C3(CN)CCCCC3)cc21.
What is the InChIKey of [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine?
The InChIKey is GUCMXZBECKVDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-13-5-6-14-7-8-15(11-16(13)14)17(12-18)9-3-2-4-10-17/h7-8,11,13H,2-6,9-10,12,18H2,1H3.
What are the key properties of [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine?
[1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine has a molecular weight of 243.39 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclohexyl]methanamine is sourced from PubChem (CID 117360942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).