N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine

C15H23N — CID 59019776

IUPACN-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine
SMILESCCN(CC)CC1(c2ccc(C)cc2)CC1
InChIInChI=1S/C15H23N/c1-4-16(5-2)12-15(10-11-15)14-8-6-13(3)7-9-14/h6-9H,4-5,10-12H2,1-3H3
InChIKeyPSWYAXKEHAKRDA-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.37
Rot. Bonds5

About N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine

N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine (PubChem CID 59019776) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine
PubChem CID59019776
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine
SMILESCCN(CC)CC1(c2ccc(C)cc2)CC1
InChIInChI=1S/C15H23N/c1-4-16(5-2)12-15(10-11-15)14-8-6-13(3)7-9-14/h6-9H,4-5,10-12H2,1-3H3
InChIKeyPSWYAXKEHAKRDA-UHFFFAOYSA-N
XLogP3.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine (CID 59019776) is N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine is CCN(CC)CC1(c2ccc(C)cc2)CC1.
What is the InChIKey of N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine?
The InChIKey is PSWYAXKEHAKRDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-4-16(5-2)12-15(10-11-15)14-8-6-13(3)7-9-14/h6-9H,4-5,10-12H2,1-3H3.
What are the key properties of N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine?
N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 59019776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).