N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine

C16H25NO — CID 79628455

IUPACN,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
SMILESCNCC(C)(C)COc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO/c1-16(2,11-17-3)12-18-15-9-8-13-6-4-5-7-14(13)10-15/h8-10,17H,4-7,11-12H2,1-3H3
InChIKeyUXPGYYLPSZNKCQ-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.19
Rot. Bonds5

About N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine

N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine (PubChem CID 79628455) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
PubChem CID79628455
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
SMILESCNCC(C)(C)COc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO/c1-16(2,11-17-3)12-18-15-9-8-13-6-4-5-7-14(13)10-15/h8-10,17H,4-7,11-12H2,1-3H3
InChIKeyUXPGYYLPSZNKCQ-UHFFFAOYSA-N
XLogP3.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-amine
CID 62353843
2-(2,3-dihydro-1H-inden-5-yloxy)-N-methylethanamine
CID 14809522
3-(6-bromonaphthalen-2-yl)oxy-N,2,2-trimethylpropan-1-amine
CID 79628620
4-(2,3-dihydro-1H-inden-5-yloxy)-N,2-dimethylbutan-2-amine
CID 94686046
2-methyl-2-(propylamino)-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-ol
CID 64810615
2-[[3-(2,3-dihydro-1H-inden-5-yloxy)-2,2-dimethylpropanoyl]amino]acetic acid
CID 92922769
N,2,2-trimethyl-3-[4-(2-methylbutan-2-yl)phenoxy]propan-1-amine
CID 79626869
N-ethyl-2-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
CID 62355231
2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide
CID 113101539
N,2,2-trimethyl-3-(1-methylpyrazol-4-yl)oxypropan-1-amine
CID 116793470
2-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
CID 28917689
N-tert-butyl-5-(2,3-dihydro-1H-inden-5-yloxy)pentan-1-amine
CID 62458571

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The IUPAC name of N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine (CID 79628455) is N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The canonical SMILES for N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine is CNCC(C)(C)COc1ccc2c(c1)CCCC2.
What is the InChIKey of N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The InChIKey is UXPGYYLPSZNKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-16(2,11-17-3)12-18-15-9-8-13-6-4-5-7-14(13)10-15/h8-10,17H,4-7,11-12H2,1-3H3.
What are the key properties of N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine has a molecular weight of 247.38 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine is sourced from PubChem (CID 79628455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).