2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide

C18H24N2O — CID 119685967

IUPAC2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide
SMILESCCC(C)C(N)C(=O)NC(C)c1ccc2ccccc2c1
InChIInChI=1S/C18H24N2O/c1-4-12(2)17(19)18(21)20-13(3)15-10-9-14-7-5-6-8-16(14)11-15/h5-13,17H,4,19H2,1-3H3,(H,20,21)
InChIKeyVRLKTCPXTLUSEY-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.39
Rot. Bonds5

About 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide

2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide (PubChem CID 119685967) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide
PubChem CID119685967
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide
SMILESCCC(C)C(N)C(=O)NC(C)c1ccc2ccccc2c1
InChIInChI=1S/C18H24N2O/c1-4-12(2)17(19)18(21)20-13(3)15-10-9-14-7-5-6-8-16(14)11-15/h5-13,17H,4,19H2,1-3H3,(H,20,21)
InChIKeyVRLKTCPXTLUSEY-UHFFFAOYSA-N
XLogP3.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-methyl-N-(1-phenylethyl)pentanamide
CID 21475942
(2S,3S)-2-amino-3-methyl-N-[(1R)-1-phenylethyl]pentanamide
CID 11565273
(2S,3S)-2-amino-3-methyl-N-[(1R)-1-phenylethyl]pentanamide;hydrochloride
CID 11565272
(2S,3S)-2-amino-3-methyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]pentanamide
CID 61178738
2-amino-N-[(1S)-1-(3-methoxyphenyl)ethyl]-3-methylpentanamide
CID 81373790
(2S)-2-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]-3-methylpentanamide
CID 61166177
(2S)-2-amino-N-[(1S)-1-(3-bromophenyl)ethyl]-3-methylpentanamide
CID 81376335
(2S)-2-amino-N-[1-(4-ethoxyphenyl)ethyl]-3-methylpentanamide
CID 61174084
(2S,3S)-2-amino-3-methyl-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 61155475
(2S,3S)-2-amino-3-methyl-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]pentanamide
CID 61180622
N-[(1R)-1-naphthalen-2-ylethyl]-2,2-diphenylacetamide
CID 7899729
2-amino-N-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethyl]-3-methylpentanamide
CID 119721222

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide?
The IUPAC name of 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide (CID 119685967) is 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide.
What is the SMILES notation for 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide?
The canonical SMILES for 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide is CCC(C)C(N)C(=O)NC(C)c1ccc2ccccc2c1.
What is the InChIKey of 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide?
The InChIKey is VRLKTCPXTLUSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-12(2)17(19)18(21)20-13(3)15-10-9-14-7-5-6-8-16(14)11-15/h5-13,17H,4,19H2,1-3H3,(H,20,21).
What are the key properties of 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide?
2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide has a molecular weight of 284.40 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-(1-naphthalen-2-ylethyl)pentanamide is sourced from PubChem (CID 119685967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).