(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride

C14H21ClN2O — CID 120873780

IUPAC(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
SMILESCC1CCc2ccccc2C1NC(=O)[C@@H](C)N.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-9-7-8-11-5-3-4-6-12(11)13(9)16-14(17)10(2)15;/h3-6,9-10,13H,7-8,15H2,1-2H3,(H,16,17);1H/t9?,10-,13?;/m1./s1
InChIKeyRWJRKOYBOXULJA-MPRHFJHCSA-N
MW268.79 g/mol
LogP2.20
Rot. Bonds2

About (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride

(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride (PubChem CID 120873780) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
PubChem CID120873780
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
SMILESCC1CCc2ccccc2C1NC(=O)[C@@H](C)N.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-9-7-8-11-5-3-4-6-12(11)13(9)16-14(17)10(2)15;/h3-6,9-10,13H,7-8,15H2,1-2H3,(H,16,17);1H/t9?,10-,13?;/m1./s1
InChIKeyRWJRKOYBOXULJA-MPRHFJHCSA-N
XLogP2.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-methoxy-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
CID 120993734
(2S)-2-amino-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]propanamide
CID 16720820
N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)prop-2-enamide
CID 162747128
(2R)-2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide;hydrochloride
CID 119270502
2-[(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120977349
2-amino-N-(2,3-dihydro-1H-inden-2-yl)propanamide
CID 14599683
2-[3-[(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-3-oxopropyl]benzoic acid
CID 120550949
1-[(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 122008246
3-chloro-2-hydroxy-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 11232317
3-(dimethylsulfamoyl)-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 75499008
2-methyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide
CID 42627892
3-methyl-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)-2-oxo-1H-imidazole-4-carboxamide
CID 126839968

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride (CID 120873780) is (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride is CC1CCc2ccccc2C1NC(=O)[C@@H](C)N.Cl.
What is the InChIKey of (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride?
The InChIKey is RWJRKOYBOXULJA-MPRHFJHCSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c1-9-7-8-11-5-3-4-6-12(11)13(9)16-14(17)10(2)15;/h3-6,9-10,13H,7-8,15H2,1-2H3,(H,16,17);1H/t9?,10-,13?;/m1./s1.
What are the key properties of (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride?
(2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 2.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride is sourced from PubChem (CID 120873780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).