1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine

C15H23NO — CID 103735607

IUPAC1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine
SMILESCCOc1ccccc1CNCC1(CC)CC1
InChIInChI=1S/C15H23NO/c1-3-15(9-10-15)12-16-11-13-7-5-6-8-14(13)17-4-2/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyUPKVVPVMOOCEAZ-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.37
Rot. Bonds7

About 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine

1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine (PubChem CID 103735607) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine
PubChem CID103735607
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine
SMILESCCOc1ccccc1CNCC1(CC)CC1
InChIInChI=1S/C15H23NO/c1-3-15(9-10-15)12-16-11-13-7-5-6-8-14(13)17-4-2/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyUPKVVPVMOOCEAZ-UHFFFAOYSA-N
XLogP3.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-6-[[(1-ethylcyclopropyl)methylamino]methyl]phenol
CID 103735468
2-[[(1-ethylcyclobutyl)methylamino]methyl]-6-methoxyphenol
CID 103741124
2-[1-[[(2-propan-2-yloxyphenyl)methylamino]methyl]cyclopropyl]ethanol
CID 114750185
N-[(2-ethoxyphenyl)methyl]-1-[2-(methoxymethyl)phenyl]methanamine
CID 60744247
N-[(1-ethylcyclopropyl)methyl]-1-pyridin-2-ylmethanamine
CID 103735456
N-[(2-ethoxyphenyl)methyl]hexan-1-amine
CID 4716807
1-(3-chloro-2-fluorophenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine
CID 115696036
N-[(1-ethylcyclobutyl)methyl]-1-(2-methyl-3-pyridinyl)methanamine
CID 115684507
N-[(2-ethoxyphenyl)methyl]-1-(4-methylphenyl)methanamine;hydrochloride
CID 6462036
2-ethoxy-6-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 63933499
1-(2-ethoxyphenyl)-N-(1,2,4-oxadiazol-3-ylmethyl)methanamine
CID 106392785
[1-[[(2-methoxyphenyl)methylamino]methyl]cyclopentyl]methanol
CID 115358929

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine (CID 103735607) is 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine is CCOc1ccccc1CNCC1(CC)CC1.
What is the InChIKey of 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine?
The InChIKey is UPKVVPVMOOCEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-15(9-10-15)12-16-11-13-7-5-6-8-14(13)17-4-2/h5-8,16H,3-4,9-12H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine?
1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine has a molecular weight of 233.35 g/mol, XLogP of 3.37, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-N-[(1-ethylcyclopropyl)methyl]methanamine is sourced from PubChem (CID 103735607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).