2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

C17H27N — CID 63403727

IUPAC2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1c2ccccc2CCC1CC(C)C
InChIInChI=1S/C17H27N/c1-4-11-18-17-15(12-13(2)3)10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,4,9-12H2,1-3H3
InChIKeyJROBSFDAIPESEV-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.34
Rot. Bonds5

About 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 63403727) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID63403727
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1c2ccccc2CCC1CC(C)C
InChIInChI=1S/C17H27N/c1-4-11-18-17-15(12-13(2)3)10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,4,9-12H2,1-3H3
InChIKeyJROBSFDAIPESEV-UHFFFAOYSA-N
XLogP4.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-ethylbutyl)-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 82932652
2-(cyclopentylmethyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63403595
2-N-methyl-2-N-(3-methylbutan-2-yl)-1-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63469194
1-chloro-2-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 63460578
2-N-methyl-2-N-(2-methylbutyl)-1-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63467737
2-methylsulfinyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64654603
6-hexyl-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63403821
2-prop-2-enylsulfanyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114272345
N-ethyl-6-(2-methylpentyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63403421
2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103487452
N-ethyl-2-methylsulfanyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64626278
1-(2,3-dihydro-1H-inden-1-yl)-3-methyl-N-propylbutan-1-amine
CID 65403398

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 63403727) is 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCCNC1c2ccccc2CCC1CC(C)C.
What is the InChIKey of 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is JROBSFDAIPESEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-4-11-18-17-15(12-13(2)3)10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,4,9-12H2,1-3H3.
What are the key properties of 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 245.41 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 63403727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).