N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine

C18H30N2O — CID 103931357

IUPACN-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
SMILESCCOCc1ccccc1NC1CCN(CC(C)C)CC1
InChIInChI=1S/C18H30N2O/c1-4-21-14-16-7-5-6-8-18(16)19-17-9-11-20(12-10-17)13-15(2)3/h5-8,15,17,19H,4,9-14H2,1-3H3
InChIKeyFXPUXMKTUMIXDP-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.76
Rot. Bonds7

About N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine

N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine (PubChem CID 103931357) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine.

Molecular Properties

Compound NameN-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
PubChem CID103931357
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
SMILESCCOCc1ccccc1NC1CCN(CC(C)C)CC1
InChIInChI=1S/C18H30N2O/c1-4-21-14-16-7-5-6-8-18(16)19-17-9-11-20(12-10-17)13-15(2)3/h5-8,15,17,19H,4,9-14H2,1-3H3
InChIKeyFXPUXMKTUMIXDP-UHFFFAOYSA-N
XLogP3.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103930824
N-[2-(ethoxymethyl)phenyl]cycloheptanamine
CID 43750302
N-(2-ethylsulfanylphenyl)-1-(2-methylpropyl)piperidin-4-amine
CID 103936271
2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline
CID 64500672
N-[[2-(ethoxymethyl)phenyl]methyl]-1-ethylpiperidin-4-amine
CID 60924202
N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine
CID 43677869
1-ethyl-N-[2-(2-methylpropoxy)phenyl]piperidin-4-amine
CID 60934851
N-[2-(ethoxymethyl)phenyl]-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658557
N-[2-(ethoxymethyl)phenyl]-5-methylthiolan-3-amine
CID 79941827
N-[(2-methylphenyl)methyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103614666
1-propan-2-yl-N-(2-propylphenyl)piperidin-4-amine
CID 43687285
2-[2-[(1-ethylpiperidin-4-yl)amino]phenyl]-N-methylacetamide
CID 43692190

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine?
The IUPAC name of N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine (CID 103931357) is N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine.
What is the SMILES notation for N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine?
The canonical SMILES for N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine is CCOCc1ccccc1NC1CCN(CC(C)C)CC1.
What is the InChIKey of N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine?
The InChIKey is FXPUXMKTUMIXDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-21-14-16-7-5-6-8-18(16)19-17-9-11-20(12-10-17)13-15(2)3/h5-8,15,17,19H,4,9-14H2,1-3H3.
What are the key properties of N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine?
N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine has a molecular weight of 290.45 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine is sourced from PubChem (CID 103931357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).