N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide

C19H25NO3 — CID 109380191

IUPACN-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide
SMILESCOc1ccc2cccc(CC(=O)NCC(O)CC(C)C)c2c1
InChIInChI=1S/C19H25NO3/c1-13(2)9-16(21)12-20-19(22)10-15-6-4-5-14-7-8-17(23-3)11-18(14)15/h4-8,11,13,16,21H,9-10,12H2,1-3H3,(H,20,22)
InChIKeyRNFMSCLBYMFMAN-UHFFFAOYSA-N
MW315.41 g/mol
LogP2.91
Rot. Bonds7

About N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide

N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide (PubChem CID 109380191) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide
PubChem CID109380191
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC NameN-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide
SMILESCOc1ccc2cccc(CC(=O)NCC(O)CC(C)C)c2c1
InChIInChI=1S/C19H25NO3/c1-13(2)9-16(21)12-20-19(22)10-15-6-4-5-14-7-8-17(23-3)11-18(14)15/h4-8,11,13,16,21H,9-10,12H2,1-3H3,(H,20,22)
InChIKeyRNFMSCLBYMFMAN-UHFFFAOYSA-N
XLogP2.91
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopentyl-2-hydroxyethyl)-2-(7-methoxynaphthalen-1-yl)acetamide
CID 109380188
3-(7-methoxynaphthalen-1-yl)-N-(2-methylpropyl)propanamide
CID 19696840
N-(2-hydroxy-4-methylpentyl)-2-(4-methoxyphenoxy)acetamide
CID 103771418
N-(2-hydroxy-4-methylpentyl)-3-(4-methoxyphenyl)propanamide
CID 103770855
2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]-2,4-dimethylpentanamide
CID 75388275
2-hydroxy-N-(2-hydroxy-4-methylpentyl)-4-methoxybenzamide
CID 103819096
N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide
CID 99801039
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
1-(7-methoxynaphthalen-1-yl)-6-methylheptan-2-ol
CID 83148133
N-(2-hydroxy-4-methylpentyl)-2,6-dimethoxybenzamide
CID 103819903
1-(2-chloro-5-methoxyphenyl)-3-(2-hydroxy-4-methylpentyl)urea
CID 111431527
3-cyclopropyl-2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120535790

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide?
The IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide (CID 109380191) is N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide is COc1ccc2cccc(CC(=O)NCC(O)CC(C)C)c2c1.
What is the InChIKey of N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide?
The InChIKey is RNFMSCLBYMFMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3/c1-13(2)9-16(21)12-20-19(22)10-15-6-4-5-14-7-8-17(23-3)11-18(14)15/h4-8,11,13,16,21H,9-10,12H2,1-3H3,(H,20,22).
What are the key properties of N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide?
N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide has a molecular weight of 315.41 g/mol, XLogP of 2.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide is sourced from PubChem (CID 109380191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).