2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride

C18H27ClN2O — CID 119758390

IUPAC2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride
SMILESCC1(C)CCC(NC(=O)CNCC2CC2)c2ccccc21.Cl
InChIInChI=1S/C18H26N2O.ClH/c1-18(2)10-9-16(14-5-3-4-6-15(14)18)20-17(21)12-19-11-13-7-8-13;/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21);1H
InChIKeyUNBDVZSPJWQASG-UHFFFAOYSA-N
MW322.88 g/mol
LogP3.34
Rot. Bonds5

About 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride (PubChem CID 119758390) has the molecular formula C18H27ClN2O and a molecular weight of 322.88 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride
PubChem CID119758390
Molecular FormulaC18H27ClN2O
Molecular Weight322.88 g/mol
Exact Mass322.18
IUPAC Name2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride
SMILESCC1(C)CCC(NC(=O)CNCC2CC2)c2ccccc21.Cl
InChIInChI=1S/C18H26N2O.ClH/c1-18(2)10-9-16(14-5-3-4-6-15(14)18)20-17(21)12-19-11-13-7-8-13;/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21);1H
InChIKeyUNBDVZSPJWQASG-UHFFFAOYSA-N
XLogP3.34
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.88
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-amino-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)heptanamide;hydrochloride
CID 119758371
N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide
CID 79377266
3-amino-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)benzamide;hydrochloride
CID 119758396
N,4,4-trimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 43147302
2-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N-methylacetamide
CID 82082245
N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)thiadiazole-5-carboxamide
CID 47472710
N-[(1R)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 52909094
2-[(4-acetylphenyl)sulfonyl-methylamino]-N-[(1R)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]acetamide
CID 52510634
N-[(1S)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 52909093
(2R)-2-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propan-1-ol
CID 114985663
N-[(1R)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]-5-sulfamoylfuran-2-carboxamide
CID 94821670
N-[(1S)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]-2-methoxypyridine-3-carboxamide
CID 52789544

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride (CID 119758390) is 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride is CC1(C)CCC(NC(=O)CNCC2CC2)c2ccccc21.Cl.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride?
The InChIKey is UNBDVZSPJWQASG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O.ClH/c1-18(2)10-9-16(14-5-3-4-6-15(14)18)20-17(21)12-19-11-13-7-8-13;/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride has a molecular weight of 322.88 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride is sourced from PubChem (CID 119758390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).