2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride

C18H25ClN2O2 — CID 119699304

IUPAC2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride
SMILESCCC(C)C(N)C(=O)NCc1ccc2cc(OC)ccc2c1.Cl
InChIInChI=1S/C18H24N2O2.ClH/c1-4-12(2)17(19)18(21)20-11-13-5-6-15-10-16(22-3)8-7-14(15)9-13;/h5-10,12,17H,4,11,19H2,1-3H3,(H,20,21);1H
InChIKeyVYHMXPOIJXHERY-UHFFFAOYSA-N
MW336.86 g/mol
LogP3.26
Rot. Bonds6

About 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride

2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride (PubChem CID 119699304) has the molecular formula C18H25ClN2O2 and a molecular weight of 336.86 g/mol. Its IUPAC name is 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride
PubChem CID119699304
Molecular FormulaC18H25ClN2O2
Molecular Weight336.86 g/mol
Exact Mass336.16
IUPAC Name2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride
SMILESCCC(C)C(N)C(=O)NCc1ccc2cc(OC)ccc2c1.Cl
InChIInChI=1S/C18H24N2O2.ClH/c1-4-12(2)17(19)18(21)20-11-13-5-6-15-10-16(22-3)8-7-14(15)9-13;/h5-10,12,17H,4,11,19H2,1-3H3,(H,20,21);1H
InChIKeyVYHMXPOIJXHERY-UHFFFAOYSA-N
XLogP3.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.86
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]propanamide;hydrochloride
CID 119276428
N-[(6-methoxynaphthalen-2-yl)methyl]-2-methylbutanamide
CID 24622689
(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide
CID 22690831
2-amino-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-methylpentanamide;hydrochloride
CID 119730113
(2S)-2-amino-N-[(4-methoxyphenyl)methyl]-3-methylbutanamide
CID 22690639
2-amino-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-methylpentanamide
CID 119730114
2-amino-3-methyl-N-[(4-propoxyphenyl)methyl]pentanamide;hydrochloride
CID 119714373
2-amino-N-[(3,4-dichlorophenyl)methyl]-3-methylpentanamide
CID 69170793
2-amino-N-[(4-chlorophenyl)methyl]-3-methylpentanamide;hydrochloride
CID 119669753
(6-methoxynaphthalen-2-yl)methylcarbamic acid
CID 115170918
(2S)-2-amino-N-[(4-methoxyphenyl)methyl]propanamide
CID 22690461
1-[(6-methoxynaphthalen-2-yl)methyl]-3-propan-2-ylurea
CID 24612075

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride (CID 119699304) is 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride is CCC(C)C(N)C(=O)NCc1ccc2cc(OC)ccc2c1.Cl.
What is the InChIKey of 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride?
The InChIKey is VYHMXPOIJXHERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2.ClH/c1-4-12(2)17(19)18(21)20-11-13-5-6-15-10-16(22-3)8-7-14(15)9-13;/h5-10,12,17H,4,11,19H2,1-3H3,(H,20,21);1H.
What are the key properties of 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride?
2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride has a molecular weight of 336.86 g/mol, XLogP of 3.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride is sourced from PubChem (CID 119699304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).