1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine

C17H27N — CID 66478211

IUPAC1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCCc1ccc(C(NC)C2C(C)(C)C2(C)C)cc1
InChIInChI=1S/C17H27N/c1-7-12-8-10-13(11-9-12)14(18-6)15-16(2,3)17(15,4)5/h8-11,14-15,18H,7H2,1-6H3
InChIKeyLQWABBYCGHICGP-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.19
Rot. Bonds4

About 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine

1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine (PubChem CID 66478211) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
PubChem CID66478211
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCCc1ccc(C(NC)C2C(C)(C)C2(C)C)cc1
InChIInChI=1S/C17H27N/c1-7-12-8-10-13(11-9-12)14(18-6)15-16(2,3)17(15,4)5/h8-11,14-15,18H,7H2,1-6H3
InChIKeyLQWABBYCGHICGP-UHFFFAOYSA-N
XLogP4.19
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 66476868
1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine
CID 43484724
(4-ethylphenyl)-(methylamino)methanethiol
CID 116954449
[(2,2-dimethylcyclopropyl)-(4-ethylphenyl)methyl]hydrazine
CID 107005599
1-(4-ethylphenyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 63414820
1-(4-methoxy-3-methylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 66476681
1-(4-ethylphenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]methanamine
CID 43480542
1-(2,3-dihydro-1-benzothiophen-3-yl)-1-(4-ethylphenyl)-N-methylmethanamine
CID 105121368
1-(4-ethylphenyl)-N,5-dimethylhexan-1-amine
CID 83161767
2-chloro-1-(4-ethylphenyl)-N-methylethanamine
CID 116952559
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 66476866
N-[(3-ethylphenyl)-(2,2,3,3-tetramethylcyclopropyl)methyl]propan-1-amine
CID 105018792

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The IUPAC name of 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine (CID 66478211) is 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine.
What is the SMILES notation for 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The canonical SMILES for 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine is CCc1ccc(C(NC)C2C(C)(C)C2(C)C)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The InChIKey is LQWABBYCGHICGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-7-12-8-10-13(11-9-12)14(18-6)15-16(2,3)17(15,4)5/h8-11,14-15,18H,7H2,1-6H3.
What are the key properties of 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine has a molecular weight of 245.41 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine is sourced from PubChem (CID 66478211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).