2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride

C16H25ClN2O — CID 119783207

IUPAC2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCC1CCc2ccccc21.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-3-10-16(2,17)15(19)18-11-13-9-8-12-6-4-5-7-14(12)13;/h4-7,13H,3,8-11,17H2,1-2H3,(H,18,19);1H
InChIKeyBSAZZJXWMQBKER-UHFFFAOYSA-N
MW296.84 g/mol
LogP2.77
Rot. Bonds5

About 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride

2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride (PubChem CID 119783207) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride
PubChem CID119783207
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCC1CCc2ccccc21.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-3-10-16(2,17)15(19)18-11-13-9-8-12-6-4-5-7-14(12)13;/h4-7,13H,3,8-11,17H2,1-2H3,(H,18,19);1H
InChIKeyBSAZZJXWMQBKER-UHFFFAOYSA-N
XLogP2.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-methyl-N-[3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)propyl]pentanamide;hydrochloride
CID 119787376
2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-phenylacetamide;hydrochloride
CID 119323377
1-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-3-[[(1S)-2,3-dihydro-1H-inden-1-yl]methyl]urea
CID 97227635
3-(2,3-dihydro-1H-inden-1-ylmethylamino)-2-methyl-3-oxopropanoic acid
CID 122065562
2-(cyclopropylmethylamino)-N-(2,3-dihydro-1H-inden-1-ylmethyl)acetamide;hydrochloride
CID 119783179
2-amino-N-(cyclooctylmethyl)-2-methylpentanamide;hydrochloride
CID 119741898
(2S,4S)-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120632479
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-2-carbamothioyl-2-methylbutanamide
CID 114292397
1-(3,3-dimethylbutyl)-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)urea
CID 166180262
4-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-3-methoxybutanamide
CID 120592176
2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
CID 60937239
2-amino-N-(2-tert-butylphenyl)-2-methylpentanamide;hydrochloride
CID 119399942

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride (CID 119783207) is 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)NCC1CCc2ccccc21.Cl.
What is the InChIKey of 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride?
The InChIKey is BSAZZJXWMQBKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O.ClH/c1-3-10-16(2,17)15(19)18-11-13-9-8-12-6-4-5-7-14(12)13;/h4-7,13H,3,8-11,17H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride?
2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride has a molecular weight of 296.84 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119783207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).