N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C15H23NO — CID 43190307

IUPACN-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCC(C)NC1CCCc2cc(OC)ccc21
InChIInChI=1S/C15H23NO/c1-4-11(2)16-15-7-5-6-12-10-13(17-3)8-9-14(12)15/h8-11,15-16H,4-7H2,1-3H3
InChIKeyVYPRZYNVIKFGOT-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.46
Rot. Bonds4

About N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 43190307) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID43190307
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCC(C)NC1CCCc2cc(OC)ccc21
InChIInChI=1S/C15H23NO/c1-4-11(2)16-15-7-5-6-12-10-13(17-3)8-9-14(12)15/h8-11,15-16H,4-7H2,1-3H3
InChIKeyVYPRZYNVIKFGOT-UHFFFAOYSA-N
XLogP3.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethylsulfanylpropan-2-yl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115725728
6-methoxy-N-pent-4-yn-2-yl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 113262380
N-(dicyclopropylmethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43096402
(2S)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-3-methylbutan-1-ol
CID 79253979
ethyl 2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanoate
CID 61498112
N-ethyl-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanamide
CID 43574212
6-methoxy-N-[(1R)-1-pyridin-4-ylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81395323
N-heptan-2-yl-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79239668
2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
CID 3016750
6-methoxy-N-(2-methyl-3-methylsulfanylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63981083
6-methoxy-N-(5-methylhexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115324453
6-methoxy-N-[(1S)-1-pyridin-2-ylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81393164

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 43190307) is N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is CCC(C)NC1CCCc2cc(OC)ccc21.
What is the InChIKey of N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is VYPRZYNVIKFGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-4-11(2)16-15-7-5-6-12-10-13(17-3)8-9-14(12)15/h8-11,15-16H,4-7H2,1-3H3.
What are the key properties of N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 43190307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).