N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide

C16H26N2O — CID 62170173

IUPACN-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)N(C)CC(C)CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-11-17-15-9-7-14(8-10-15)16(19)18(4)12-13(3)6-2/h7-10,13,17H,5-6,11-12H2,1-4H3
InChIKeyYEOWRHOIGHJJOE-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.63
Rot. Bonds7

About N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide

N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide (PubChem CID 62170173) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide
PubChem CID62170173
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)N(C)CC(C)CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-11-17-15-9-7-14(8-10-15)16(19)18(4)12-13(3)6-2/h7-10,13,17H,5-6,11-12H2,1-4H3
InChIKeyYEOWRHOIGHJJOE-UHFFFAOYSA-N
XLogP3.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxypropyl)-N-methyl-4-(propylamino)benzamide
CID 62335915
N-ethyl-4-(ethylamino)-N-(2-methylbutyl)benzamide
CID 79470101
N-(5-hydroxypentyl)-N-methyl-4-(propylamino)benzamide
CID 107201178
N-(2-cyanoethyl)-N-(2-methylpropyl)-4-(propylamino)benzamide
CID 62180118
3-amino-4-fluoro-N-methyl-N-(2-methylbutyl)benzamide
CID 43437024
3-amino-4-chloro-N-methyl-N-(2-methylbutyl)benzamide
CID 43295327
N-butan-2-yl-4-(propylamino)benzamide
CID 62171300
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-4-(propylamino)benzamide
CID 62179777
1-[4-(propylamino)phenyl]ethanone
CID 7304598
N-(2,3-dimethylbutyl)-4-(propylamino)benzamide
CID 64581359
N-(5-methylhexyl)-4-(propylamino)benzamide
CID 115327309
N-methyl-4-(methylamino)-N-(2-methylbutyl)-3-(trifluoromethyl)benzamide
CID 62168801

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide?
The IUPAC name of N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide (CID 62170173) is N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide.
What is the SMILES notation for N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide?
The canonical SMILES for N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide is CCCNc1ccc(C(=O)N(C)CC(C)CC)cc1.
What is the InChIKey of N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide?
The InChIKey is YEOWRHOIGHJJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-11-17-15-9-7-14(8-10-15)16(19)18(4)12-13(3)6-2/h7-10,13,17H,5-6,11-12H2,1-4H3.
What are the key properties of N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide?
N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide has a molecular weight of 262.40 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylbutyl)-4-(propylamino)benzamide is sourced from PubChem (CID 62170173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).