9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride

C19H25Cl2N3 — CID 75531489

IUPAC9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride
SMILESCCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl.Cl
InChIInChI=1S/C19H23N3.2ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;;/h3-8,13,20H,2,9-12,14H2,1H3;2*1H
InChIKeyXYPULRDTXCRDLO-UHFFFAOYSA-N
MW366.34 g/mol
LogP4.06
Rot. Bonds3

About 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride

9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride (PubChem CID 75531489) has the molecular formula C19H25Cl2N3 and a molecular weight of 366.34 g/mol. Its IUPAC name is 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride.

Molecular Properties

Compound Name9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride
PubChem CID75531489
Molecular FormulaC19H25Cl2N3
Molecular Weight366.34 g/mol
Exact Mass365.14
IUPAC Name9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride
SMILESCCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl.Cl
InChIInChI=1S/C19H23N3.2ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;;/h3-8,13,20H,2,9-12,14H2,1H3;2*1H
InChIKeyXYPULRDTXCRDLO-UHFFFAOYSA-N
XLogP4.06
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.34
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
CID 156592203
9-ethyl-3-[(4-phenylpiperazin-1-yl)methyl]carbazole
CID 2058524
9-ethyl-3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]carbazole
CID 2845430
3-[[(3R,5R)-3,5-dimethylpiperidin-1-yl]methyl]-9-ethylcarbazole
CID 1378344
9-ethyl-3-[[4-(naphthalen-2-ylmethyl)piperazin-1-yl]methyl]carbazole;oxalic acid
CID 17366921
1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]-3-methoxypropan-1-one
CID 6733236
9-ethyl-3-[[4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)piperazin-1-yl]methyl]carbazole
CID 72548879
9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole
CID 171282163
9-ethyl-3-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]carbazole;oxalic acid
CID 17366842
4-[[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]methyl]-2,6-dimethoxyphenol;oxalic acid
CID 17366841
9-ethyl-3-[[4-(4-ethylpiperazin-1-yl)piperidin-1-yl]methyl]carbazole;oxalic acid
CID 163326617
1-[(9-ethylcarbazol-3-yl)methyl]piperidine-3-carbonitrile
CID 67996668

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride?
The IUPAC name of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride (CID 75531489) is 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride.
What is the SMILES notation for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride?
The canonical SMILES for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride is CCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl.Cl.
What is the InChIKey of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride?
The InChIKey is XYPULRDTXCRDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3.2ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;;/h3-8,13,20H,2,9-12,14H2,1H3;2*1H.
What are the key properties of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride?
9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride has a molecular weight of 366.34 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride is sourced from PubChem (CID 75531489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).