N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide

C14H20BrN3O — CID 43607437

IUPACN-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(Br)c1)C1CCNCC1
InChIInChI=1S/C14H20BrN3O/c1-18(13-5-7-16-8-6-13)10-14(19)17-12-4-2-3-11(15)9-12/h2-4,9,13,16H,5-8,10H2,1H3,(H,17,19)
InChIKeyFGIWKARAFORMRN-UHFFFAOYSA-N
MW326.24 g/mol
LogP2.07
Rot. Bonds4

About N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide

N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide (PubChem CID 43607437) has the molecular formula C14H20BrN3O and a molecular weight of 326.24 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
PubChem CID43607437
Molecular FormulaC14H20BrN3O
Molecular Weight326.24 g/mol
Exact Mass325.08
IUPAC NameN-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(Br)c1)C1CCNCC1
InChIInChI=1S/C14H20BrN3O/c1-18(13-5-7-16-8-6-13)10-14(19)17-12-4-2-3-11(15)9-12/h2-4,9,13,16H,5-8,10H2,1H3,(H,17,19)
InChIKeyFGIWKARAFORMRN-UHFFFAOYSA-N
XLogP2.07
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.24
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[azepan-4-yl(methyl)amino]-N-(3-bromophenyl)acetamide
CID 104979514
N-(3-ethylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607180
2-[methyl(piperidin-4-yl)amino]-N-(3-propan-2-ylphenyl)acetamide;hydrochloride
CID 119912537
2-[azepan-4-yl(methyl)amino]-N-(4-bromophenyl)acetamide
CID 104979596
2-[acetyl(cyclopropyl)amino]-N-(3-bromophenyl)acetamide
CID 113158461
N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607288
2-[acetyl(cyclohexyl)amino]-N-(3-bromophenyl)acetamide
CID 113159568
N-(4-bromo-2-fluorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607565
1-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]ethanone
CID 62031890
N-(3-chloro-4-methylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607404
N-(3-methylphenyl)-4-[methyl(piperidin-4-yl)amino]butanamide
CID 43607677
N-(3-methoxyphenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922797

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide (CID 43607437) is N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide is CN(CC(=O)Nc1cccc(Br)c1)C1CCNCC1.
What is the InChIKey of N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The InChIKey is FGIWKARAFORMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrN3O/c1-18(13-5-7-16-8-6-13)10-14(19)17-12-4-2-3-11(15)9-12/h2-4,9,13,16H,5-8,10H2,1H3,(H,17,19).
What are the key properties of N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide has a molecular weight of 326.24 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 43607437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).