2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide

C14H20N2O — CID 114997863

IUPAC2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(C(C)N(C)C(=O)C2CC2N)cc1
InChIInChI=1S/C14H20N2O/c1-9-4-6-11(7-5-9)10(2)16(3)14(17)12-8-13(12)15/h4-7,10,12-13H,8,15H2,1-3H3
InChIKeyXVUINFMYTNGWBV-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.86
Rot. Bonds3

About 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide

2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide (PubChem CID 114997863) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide
PubChem CID114997863
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(C(C)N(C)C(=O)C2CC2N)cc1
InChIInChI=1S/C14H20N2O/c1-9-4-6-11(7-5-9)10(2)16(3)14(17)12-8-13(12)15/h4-7,10,12-13H,8,15H2,1-3H3
InChIKeyXVUINFMYTNGWBV-UHFFFAOYSA-N
XLogP1.86
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-[1-(4-fluorophenyl)ethyl]-N-methyloxolane-3-carboxamide
CID 66240658
(2R)-2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]propanamide
CID 78973314
(3S)-N-methyl-N-[1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81129873
4-amino-N-[1-(4-chlorophenyl)ethyl]-N-methylcyclopent-2-ene-1-carboxamide
CID 79210718
2-amino-N-[1-(3,4-difluorophenyl)ethyl]-N-methylcyclopentane-1-carboxamide
CID 64824759
2-amino-N-methyl-N-[(4-propan-2-ylphenyl)methyl]cyclopropane-1-carboxamide
CID 114997651
3-amino-N,2-dimethyl-N-[1-(4-methylphenyl)ethyl]-3-phenylpropanamide
CID 119717391
N-methyl-N-[1-(4-methylphenyl)ethyl]but-2-enamide
CID 112725740
N-methyl-2-(methylamino)-N-[1-(4-methylphenyl)ethyl]propanamide
CID 62637498
N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
CID 60737715
4-amino-N-[1-(4-chlorophenyl)ethyl]-N-methylcyclohexane-1-carboxamide
CID 60939297
1-(furan-2-carbonyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]piperidine-4-carboxamide
CID 134054283

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide?
The IUPAC name of 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide (CID 114997863) is 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide is Cc1ccc(C(C)N(C)C(=O)C2CC2N)cc1.
What is the InChIKey of 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide?
The InChIKey is XVUINFMYTNGWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-9-4-6-11(7-5-9)10(2)16(3)14(17)12-8-13(12)15/h4-7,10,12-13H,8,15H2,1-3H3.
What are the key properties of 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide?
2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 114997863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).