(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

C17H25NO — CID 115057908

IUPAC(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCOc1ccc2c(c1)C(C1CCCC1)C(CN)CC2
InChIInChI=1S/C17H25NO/c1-19-15-9-8-12-6-7-14(11-18)17(16(12)10-15)13-4-2-3-5-13/h8-10,13-14,17H,2-7,11,18H2,1H3
InChIKeyHUESEEQLTOVAML-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.49
Rot. Bonds3

About (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 115057908) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
PubChem CID115057908
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCOc1ccc2c(c1)C(C1CCCC1)C(CN)CC2
InChIInChI=1S/C17H25NO/c1-19-15-9-8-12-6-7-14(11-18)17(16(12)10-15)13-4-2-3-5-13/h8-10,13-14,17H,2-7,11,18H2,1H3
InChIKeyHUESEEQLTOVAML-UHFFFAOYSA-N
XLogP3.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(7-bromo-1-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115057906
(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115057911
6-methoxy-1,2,3,4,4a,9,10,10a-octahydrophenanthrene
CID 134188965
2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethanamine
CID 10900371
6-methoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627821
2-amino-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol;hydrochloride
CID 52911309
6-methoxy-2,3-dihydro-1H-indene-1-thiol
CID 79374496
(1S)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71756873
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115559637
(1R,2S)-1-benzyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 118023139
(1R,2S)-2,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 66798065
(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 15718592

Frequently Asked Questions

What is the IUPAC name of (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (CID 115057908) is (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is COc1ccc2c(c1)C(C1CCCC1)C(CN)CC2.
What is the InChIKey of (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is HUESEEQLTOVAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-19-15-9-8-12-6-7-14(11-18)17(16(12)10-15)13-4-2-3-5-13/h8-10,13-14,17H,2-7,11,18H2,1H3.
What are the key properties of (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 259.39 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 115057908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).