2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide

C14H20N2O — CID 63954074

IUPAC2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide
SMILESCCN(CC1CC1)C(=O)c1c(C)cccc1N
InChIInChI=1S/C14H20N2O/c1-3-16(9-11-7-8-11)14(17)13-10(2)5-4-6-12(13)15/h4-6,11H,3,7-9,15H2,1-2H3
InChIKeyWSNWXYKHAKQCPR-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.45
Rot. Bonds4

About 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide

2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide (PubChem CID 63954074) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide
PubChem CID63954074
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide
SMILESCCN(CC1CC1)C(=O)c1c(C)cccc1N
InChIInChI=1S/C14H20N2O/c1-3-16(9-11-7-8-11)14(17)13-10(2)5-4-6-12(13)15/h4-6,11H,3,7-9,15H2,1-2H3
InChIKeyWSNWXYKHAKQCPR-UHFFFAOYSA-N
XLogP2.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.45
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-6-methyl-N-propylbenzamide
CID 43268247
2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-6-methylbenzamide
CID 61108963
6-amino-N-(cyclopropylmethyl)-N-ethylpyridine-2-carboxamide
CID 63940117
N-ethyl-2,6-dihydroxy-N-(piperidin-4-ylmethyl)benzamide
CID 107690375
N-(cyclopropylmethyl)-N-ethyl-2-fluoro-6-hydroxybenzamide
CID 104917550
N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide
CID 82829503
4-amino-N-(cyclopropylmethyl)-N-ethylbenzamide
CID 63956122
3-(2-aminophenyl)-N-(cyclopropylmethyl)-N-ethylpropanamide
CID 63957099
2-amino-N-[(3-chlorophenyl)methyl]-N-ethyl-6-methylbenzamide
CID 61106536
cyclopropylmethyl 2-amino-6-methylbenzoate
CID 61310985
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-6-methylbenzamide
CID 61114023
2-amino-N-(cyclopropylmethyl)-N-propylbenzamide
CID 22493330

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide?
The IUPAC name of 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide (CID 63954074) is 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide.
What is the SMILES notation for 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide?
The canonical SMILES for 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide is CCN(CC1CC1)C(=O)c1c(C)cccc1N.
What is the InChIKey of 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide?
The InChIKey is WSNWXYKHAKQCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-16(9-11-7-8-11)14(17)13-10(2)5-4-6-12(13)15/h4-6,11H,3,7-9,15H2,1-2H3.
What are the key properties of 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide?
2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide is sourced from PubChem (CID 63954074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).