2-amino-5-methyl-N,N-dipropylbenzamide

C14H22N2O — CID 62073624

IUPAC2-amino-5-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cc(C)ccc1N
InChIInChI=1S/C14H22N2O/c1-4-8-16(9-5-2)14(17)12-10-11(3)6-7-13(12)15/h6-7,10H,4-5,8-9,15H2,1-3H3
InChIKeyAHUWXJCZMMTIKN-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.84
Rot. Bonds5

About 2-amino-5-methyl-N,N-dipropylbenzamide

2-amino-5-methyl-N,N-dipropylbenzamide (PubChem CID 62073624) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-amino-5-methyl-N,N-dipropylbenzamide.

Molecular Properties

Compound Name2-amino-5-methyl-N,N-dipropylbenzamide
PubChem CID62073624
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-amino-5-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cc(C)ccc1N
InChIInChI=1S/C14H22N2O/c1-4-8-16(9-5-2)14(17)12-10-11(3)6-7-13(12)15/h6-7,10H,4-5,8-9,15H2,1-3H3
InChIKeyAHUWXJCZMMTIKN-UHFFFAOYSA-N
XLogP2.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-ethyl-5-methyl-N-propylbenzamide
CID 62511065
2-methoxy-5-methyl-N,N-dipropylbenzamide
CID 110761077
2-amino-N-(2-ethoxyethyl)-N-ethyl-5-methylbenzamide
CID 63690620
5-methyl-2-(methylamino)-N,N-dipropylbenzamide
CID 55082842
2-amino-N,N-bis(cyanomethyl)-5-methylbenzamide
CID 62508953
2-amino-N,N-dipropylbenzamide
CID 16769117
2-bromo-N-[2-(dimethylamino)ethyl]-5-methyl-N-propylbenzamide
CID 81005126
N-(2-aminoethyl)-2,4-dimethyl-N-propylbenzamide
CID 61349150
2-amino-N,N-dipropylbenzamide;hydrochloride
CID 119943594
2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-5-methylbenzamide
CID 107477906
N-ethyl-2-fluoro-4-methyl-N-propylbenzamide
CID 79779356
N-[2-(dimethylamino)ethyl]-2-fluoro-4-methyl-N-propylbenzamide
CID 79796018

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methyl-N,N-dipropylbenzamide?
The IUPAC name of 2-amino-5-methyl-N,N-dipropylbenzamide (CID 62073624) is 2-amino-5-methyl-N,N-dipropylbenzamide.
What is the SMILES notation for 2-amino-5-methyl-N,N-dipropylbenzamide?
The canonical SMILES for 2-amino-5-methyl-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1cc(C)ccc1N.
What is the InChIKey of 2-amino-5-methyl-N,N-dipropylbenzamide?
The InChIKey is AHUWXJCZMMTIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-8-16(9-5-2)14(17)12-10-11(3)6-7-13(12)15/h6-7,10H,4-5,8-9,15H2,1-3H3.
What are the key properties of 2-amino-5-methyl-N,N-dipropylbenzamide?
2-amino-5-methyl-N,N-dipropylbenzamide has a molecular weight of 234.34 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methyl-N,N-dipropylbenzamide is sourced from PubChem (CID 62073624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).