1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine

C14H23N3 — CID 117041410

IUPAC1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine
SMILESCNc1ccc(N(C)C2CCN(C)CC2)cc1
InChIInChI=1S/C14H23N3/c1-15-12-4-6-13(7-5-12)17(3)14-8-10-16(2)11-9-14/h4-7,14-15H,8-11H2,1-3H3
InChIKeyUKFNBGTZBDWPSC-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.26
Rot. Bonds3

About 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine

1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine (PubChem CID 117041410) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine.

Molecular Properties

Compound Name1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine
PubChem CID117041410
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine
SMILESCNc1ccc(N(C)C2CCN(C)CC2)cc1
InChIInChI=1S/C14H23N3/c1-15-12-4-6-13(7-5-12)17(3)14-8-10-16(2)11-9-14/h4-7,14-15H,8-11H2,1-3H3
InChIKeyUKFNBGTZBDWPSC-UHFFFAOYSA-N
XLogP2.26
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]ethanol
CID 43505995
2-(methylamino)-1-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]ethanol
CID 83971897
N-[4-[(cyclopropylamino)methyl]phenyl]-N,1-dimethylpiperidin-4-amine
CID 43280922
2,4-difluoro-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]benzenesulfonamide
CID 166200999
N-methyl-4-[2-(1-methylpiperidin-4-yl)ethyl]aniline
CID 175496866
N-(4-bromophenyl)-N,1-dimethylpyrrolidin-3-amine
CID 83844779
3-[4-(dimethylamino)phenyl]-1-methyl-1-(1-methylpiperidin-4-yl)urea
CID 108894718
2,4-difluoro-6-hydroxy-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]benzamide
CID 71883384
5-[methyl-(1-methylpiperidin-4-yl)amino]pyridine-2-carbonitrile
CID 113320538
4-[amino-(1-methylpyrrolidin-3-yl)methyl]-N-methylaniline
CID 116936927
N-[4-(dimethylamino)phenyl]-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 2095190
4-[methyl-(1-methylpyrrolidin-3-yl)amino]benzonitrile
CID 146510734

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine?
The IUPAC name of 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine (CID 117041410) is 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine.
What is the SMILES notation for 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine?
The canonical SMILES for 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine is CNc1ccc(N(C)C2CCN(C)CC2)cc1.
What is the InChIKey of 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine?
The InChIKey is UKFNBGTZBDWPSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-15-12-4-6-13(7-5-12)17(3)14-8-10-16(2)11-9-14/h4-7,14-15H,8-11H2,1-3H3.
What are the key properties of 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine?
1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine has a molecular weight of 233.36 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine is sourced from PubChem (CID 117041410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).