N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride

C15H23ClN2O — CID 19773305

IUPACN-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
SMILESCCCNC1CCc2c(cccc2NC(C)=O)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-3-9-16-13-7-8-14-12(10-13)5-4-6-15(14)17-11(2)18;/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,18);1H
InChIKeyRNCSSVVCKOVIFR-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.92
Rot. Bonds4

About N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride

N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride (PubChem CID 19773305) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
PubChem CID19773305
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
SMILESCCCNC1CCc2c(cccc2NC(C)=O)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-3-9-16-13-7-8-14-12(10-13)5-4-6-15(14)17-11(2)18;/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,18);1H
InChIKeyRNCSSVVCKOVIFR-UHFFFAOYSA-N
XLogP2.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride?
The IUPAC name of N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride (CID 19773305) is N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride.
What is the SMILES notation for N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride?
The canonical SMILES for N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride is CCCNC1CCc2c(cccc2NC(C)=O)C1.Cl.
What is the InChIKey of N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride?
The InChIKey is RNCSSVVCKOVIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-3-9-16-13-7-8-14-12(10-13)5-4-6-15(14)17-11(2)18;/h4-6,13,16H,3,7-10H2,1-2H3,(H,17,18);1H.
What are the key properties of N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride?
N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(propylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride is sourced from PubChem (CID 19773305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).