1-(2-bromophenyl)-N-ethylpiperidin-4-amine

C13H19BrN2 — CID 60862139

IUPAC1-(2-bromophenyl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccccc2Br)CC1
InChIInChI=1S/C13H19BrN2/c1-2-15-11-7-9-16(10-8-11)13-6-4-3-5-12(13)14/h3-6,11,15H,2,7-10H2,1H3
InChIKeyDOWNSDAIJJNEJH-UHFFFAOYSA-N
MW283.21 g/mol
LogP3.03
Rot. Bonds3

About 1-(2-bromophenyl)-N-ethylpiperidin-4-amine

1-(2-bromophenyl)-N-ethylpiperidin-4-amine (PubChem CID 60862139) has the molecular formula C13H19BrN2 and a molecular weight of 283.21 g/mol. Its IUPAC name is 1-(2-bromophenyl)-N-ethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-bromophenyl)-N-ethylpiperidin-4-amine
PubChem CID60862139
Molecular FormulaC13H19BrN2
Molecular Weight283.21 g/mol
Exact Mass282.07
IUPAC Name1-(2-bromophenyl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccccc2Br)CC1
InChIInChI=1S/C13H19BrN2/c1-2-15-11-7-9-16(10-8-11)13-6-4-3-5-12(13)14/h3-6,11,15H,2,7-10H2,1H3
InChIKeyDOWNSDAIJJNEJH-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313
N-ethyl-1-(2-propylphenyl)piperidin-4-amine
CID 54963841
1-(2-bromo-5-fluorophenyl)-N-ethylpiperidin-4-amine
CID 107636369
N-ethyl-1-(2-ethylsulfonylphenyl)piperidin-4-amine
CID 60807769
1-(3-bromo-2-methylphenyl)-N-propylpiperidin-4-amine
CID 107636284
2-[[1-(2-bromophenyl)pyrrolidin-3-yl]amino]acetic acid
CID 117004212
1-(2-bromo-3-chlorophenyl)-N-ethylpyrrolidin-3-amine
CID 103480318
1-[1-(2-bromophenyl)pyrrolidin-3-yl]-3-ethyl-2-propylguanidine
CID 111922261
N-ethyl-1-[2-(trifluoromethyl)phenyl]pyrrolidin-3-amine
CID 43315015
1-(2-bromophenyl)-N-ethyl-2,3-dimethylpiperidin-4-amine
CID 79396641
1-(5-chloro-2-methylphenyl)-N-ethylpiperidin-4-amine
CID 54927324
N-ethyl-1-(2-phenoxyphenyl)pyrrolidin-3-amine
CID 43315198

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-N-ethylpiperidin-4-amine?
The IUPAC name of 1-(2-bromophenyl)-N-ethylpiperidin-4-amine (CID 60862139) is 1-(2-bromophenyl)-N-ethylpiperidin-4-amine.
What is the SMILES notation for 1-(2-bromophenyl)-N-ethylpiperidin-4-amine?
The canonical SMILES for 1-(2-bromophenyl)-N-ethylpiperidin-4-amine is CCNC1CCN(c2ccccc2Br)CC1.
What is the InChIKey of 1-(2-bromophenyl)-N-ethylpiperidin-4-amine?
The InChIKey is DOWNSDAIJJNEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN2/c1-2-15-11-7-9-16(10-8-11)13-6-4-3-5-12(13)14/h3-6,11,15H,2,7-10H2,1H3.
What are the key properties of 1-(2-bromophenyl)-N-ethylpiperidin-4-amine?
1-(2-bromophenyl)-N-ethylpiperidin-4-amine has a molecular weight of 283.21 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-N-ethylpiperidin-4-amine is sourced from PubChem (CID 60862139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).