4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide

C19H32N2O — CID 143307658

IUPAC4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide
SMILESCCCN(C)Cc1cc(C(=O)N(CCC)CCC)ccc1C
InChIInChI=1S/C19H32N2O/c1-6-11-20(5)15-18-14-17(10-9-16(18)4)19(22)21(12-7-2)13-8-3/h9-10,14H,6-8,11-13,15H2,1-5H3
InChIKeyVUDSPMGSHWXVQM-UHFFFAOYSA-N
MW304.48 g/mol
LogP4.10
Rot. Bonds9

About 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide

4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide (PubChem CID 143307658) has the molecular formula C19H32N2O and a molecular weight of 304.48 g/mol. Its IUPAC name is 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide.

Molecular Properties

Compound Name4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide
PubChem CID143307658
Molecular FormulaC19H32N2O
Molecular Weight304.48 g/mol
Exact Mass304.25
IUPAC Name4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide
SMILESCCCN(C)Cc1cc(C(=O)N(CCC)CCC)ccc1C
InChIInChI=1S/C19H32N2O/c1-6-11-20(5)15-18-14-17(10-9-16(18)4)19(22)21(12-7-2)13-8-3/h9-10,14H,6-8,11-13,15H2,1-5H3
InChIKeyVUDSPMGSHWXVQM-UHFFFAOYSA-N
XLogP4.10
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.48
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-3-methyl-N,N-dipropylbenzamide
CID 63212171
3-(methanesulfonamido)-4-methyl-N,N-dipropylbenzamide
CID 134062114
ethane;4-methyl-N,N-dipropylbenzamide
CID 143600655
6-ethyl-N,N-dipropylnaphthalene-2-carboxamide
CID 153338338
4-bromo-3-[[methyl(propyl)amino]methyl]benzoic acid
CID 165458508
3-methyl-4-nitro-N,N-dipropylbenzamide
CID 786985
4-bromo-N-(2-hydroxyethyl)-3-methyl-N-propylbenzamide
CID 112706331
3-benzamido-4-methyl-N,N-dipropylbenzamide
CID 17226384
N-benzyl-3-bromo-4-methyl-N-propylbenzamide
CID 81458013
N-(2-bromoethyl)-4-fluoro-3-methyl-N-propylbenzamide
CID 80660124
4-amino-3-hydroxy-N,N-dipropylbenzamide
CID 22411148
benzene;formaldehyde;4-methyl-N,N-dipropylbenzamide
CID 144812222

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide?
The IUPAC name of 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide (CID 143307658) is 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide.
What is the SMILES notation for 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide?
The canonical SMILES for 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide is CCCN(C)Cc1cc(C(=O)N(CCC)CCC)ccc1C.
What is the InChIKey of 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide?
The InChIKey is VUDSPMGSHWXVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O/c1-6-11-20(5)15-18-14-17(10-9-16(18)4)19(22)21(12-7-2)13-8-3/h9-10,14H,6-8,11-13,15H2,1-5H3.
What are the key properties of 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide?
4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide has a molecular weight of 304.48 g/mol, XLogP of 4.10, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[[methyl(propyl)amino]methyl]-N,N-dipropylbenzamide is sourced from PubChem (CID 143307658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).