1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide

C14H20N2O — CID 65465254

IUPAC1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-9(2)11-6-4-5-10(3)12(11)16-13(17)14(15)7-8-14/h4-6,9H,7-8,15H2,1-3H3,(H,16,17)
InChIKeyUNCFSQLTTCIBEQ-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.55
Rot. Bonds3

About 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide

1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide (PubChem CID 65465254) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide
PubChem CID65465254
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-9(2)11-6-4-5-10(3)12(11)16-13(17)14(15)7-8-14/h4-6,9H,7-8,15H2,1-3H3,(H,16,17)
InChIKeyUNCFSQLTTCIBEQ-UHFFFAOYSA-N
XLogP2.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-carbamothioyl-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide
CID 80592389
N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 729062
2,2-dichloro-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide
CID 51297991
2-(1-aminocyclopentyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 64683534
1-N-(4-chlorophenyl)-1-N'-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108982167
1-N',1-N'-diethyl-1-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108979075
2-ethyl-N-(2-methyl-6-propan-2-ylphenyl)pyrrolidine-2-carboxamide
CID 83079717
2-(1-hydroxycyclopentyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 111720133
1-(2-methyl-6-propan-2-ylphenyl)-3-(1-phenylcyclopropyl)urea
CID 113215098
1-N-(2,4-difluorophenyl)-1-N'-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108982192
1-N-[(4-chlorophenyl)methyl]-1-N'-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108976096
2-chloro-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 3859248

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide (CID 65465254) is 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide is Cc1cccc(C(C)C)c1NC(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide?
The InChIKey is UNCFSQLTTCIBEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-9(2)11-6-4-5-10(3)12(11)16-13(17)14(15)7-8-14/h4-6,9H,7-8,15H2,1-3H3,(H,16,17).
What are the key properties of 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide?
1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65465254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).