N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide

C17H28N2O — CID 43692234

IUPACN-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide
SMILESCCC(C)CC(CC)Nc1ccccc1CC(=O)NC
InChIInChI=1S/C17H28N2O/c1-5-13(3)11-15(6-2)19-16-10-8-7-9-14(16)12-17(20)18-4/h7-10,13,15,19H,5-6,11-12H2,1-4H3,(H,18,20)
InChIKeyUYHCSYPIANHGNB-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.60
Rot. Bonds8

About N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide

N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide (PubChem CID 43692234) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide
PubChem CID43692234
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide
SMILESCCC(C)CC(CC)Nc1ccccc1CC(=O)NC
InChIInChI=1S/C17H28N2O/c1-5-13(3)11-15(6-2)19-16-10-8-7-9-14(16)12-17(20)18-4/h7-10,13,15,19H,5-6,11-12H2,1-4H3,(H,18,20)
InChIKeyUYHCSYPIANHGNB-UHFFFAOYSA-N
XLogP3.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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2-[2-(1-methoxypropan-2-ylamino)phenyl]-N-methylacetamide
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2-chloro-N-(5-methylheptan-3-yl)aniline
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CID 43692229
N-methyl-2-[2-[1-(2-methylphenyl)ethylamino]phenyl]acetamide
CID 43692245
2-[2-(5-methylheptan-3-ylamino)phenyl]sulfanylacetamide
CID 43722576
N-(5-methylheptan-3-yl)-2-methylsulfonylaniline
CID 43724656
2-[2-[1-(4-iodophenyl)ethylamino]phenyl]-N-methylacetamide
CID 43782874
3-amino-2-methyl-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
CID 55105612
N-methyl-2-[2-[1-(1,3-thiazol-4-yl)ethylamino]phenyl]acetamide
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2-[2-(methanesulfonamido)phenyl]-N-methylacetamide
CID 61061403

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide?
The IUPAC name of N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide (CID 43692234) is N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide.
What is the SMILES notation for N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide?
The canonical SMILES for N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide is CCC(C)CC(CC)Nc1ccccc1CC(=O)NC.
What is the InChIKey of N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide?
The InChIKey is UYHCSYPIANHGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-13(3)11-15(6-2)19-16-10-8-7-9-14(16)12-17(20)18-4/h7-10,13,15,19H,5-6,11-12H2,1-4H3,(H,18,20).
What are the key properties of N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide?
N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide has a molecular weight of 276.42 g/mol, XLogP of 3.60, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(5-methylheptan-3-ylamino)phenyl]acetamide is sourced from PubChem (CID 43692234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).