N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine

C14H23N3 — CID 174624334

IUPACN-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(Nc2cccc(CN)c2)CC1
InChIInChI=1S/C14H23N3/c1-2-17-8-6-13(7-9-17)16-14-5-3-4-12(10-14)11-15/h3-5,10,13,16H,2,6-9,11,15H2,1H3
InChIKeySFGISVJRZOOSTH-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.04
Rot. Bonds4

About N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine

N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine (PubChem CID 174624334) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine
PubChem CID174624334
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(Nc2cccc(CN)c2)CC1
InChIInChI=1S/C14H23N3/c1-2-17-8-6-13(7-9-17)16-14-5-3-4-12(10-14)11-15/h3-5,10,13,16H,2,6-9,11,15H2,1H3
InChIKeySFGISVJRZOOSTH-UHFFFAOYSA-N
XLogP2.04
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[3-[(1-ethylpiperidin-4-yl)amino]phenyl]methyl]-N-methylacetamide
CID 43724371
N-[3-[(1-ethylpiperidin-4-yl)amino]phenyl]methanesulfonamide
CID 28731349
N-(3-bromophenyl)-1-ethylazepan-4-amine
CID 65072536
[3-[(1-methylpiperidin-4-yl)amino]phenyl]methanol
CID 43715020
4-[3-[(dimethylamino)methyl]anilino]piperidine-1-carboxamide
CID 43782212
N-[3-(methoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103931159
N-[3-(aminomethyl)phenyl]-3-(4-ethylpiperazin-1-yl)propanamide
CID 16793720
N-cyclohexyl-3-ethylaniline
CID 11009024
1-(2-aminoethyl)-N-(3-fluorophenyl)piperidin-4-amine
CID 117027556
1-[4-[3-[(dimethylamino)methyl]anilino]piperidin-1-yl]ethanone
CID 43782188
N-(3-ethylphenyl)-1-propan-2-ylazepan-4-amine
CID 65072849
3-[(1-benzylpiperidin-4-yl)amino]phenol
CID 28722324

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine?
The IUPAC name of N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine (CID 174624334) is N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine is CCN1CCC(Nc2cccc(CN)c2)CC1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine?
The InChIKey is SFGISVJRZOOSTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-17-8-6-13(7-9-17)16-14-5-3-4-12(10-14)11-15/h3-5,10,13,16H,2,6-9,11,15H2,1H3.
What are the key properties of N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine?
N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-1-ethylpiperidin-4-amine is sourced from PubChem (CID 174624334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).