6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine

C14H18ClN3 — CID 130361840

IUPAC6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine
SMILESCN1CCC(Nc2cc(Cl)cc3[nH]ccc23)CC1
InChIInChI=1S/C14H18ClN3/c1-18-6-3-11(4-7-18)17-14-9-10(15)8-13-12(14)2-5-16-13/h2,5,8-9,11,16-17H,3-4,6-7H2,1H3
InChIKeyFTESINPVEGAGCL-UHFFFAOYSA-N
MW263.77 g/mol
LogP3.33
Rot. Bonds2

About 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine

6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine (PubChem CID 130361840) has the molecular formula C14H18ClN3 and a molecular weight of 263.77 g/mol. Its IUPAC name is 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine.

Molecular Properties

Compound Name6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine
PubChem CID130361840
Molecular FormulaC14H18ClN3
Molecular Weight263.77 g/mol
Exact Mass263.12
IUPAC Name6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine
SMILESCN1CCC(Nc2cc(Cl)cc3[nH]ccc23)CC1
InChIInChI=1S/C14H18ClN3/c1-18-6-3-11(4-7-18)17-14-9-10(15)8-13-12(14)2-5-16-13/h2,5,8-9,11,16-17H,3-4,6-7H2,1H3
InChIKeyFTESINPVEGAGCL-UHFFFAOYSA-N
XLogP3.33
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-N-[[6-[(1-methylpiperidin-4-yl)methylamino]-3-pyridinyl]methyl]-1H-indol-4-amine
CID 171362702
N-(6-chloro-1H-indol-4-yl)acetamide
CID 122534007
N-(2,5-dichloro-4-methylphenyl)-1-methylpiperidin-4-amine
CID 104726369
N-(3-chlorophenyl)-1-methylpiperidin-4-amine
CID 13336311
6-chloro-N-(6-cyclopropyl-2-pyridinyl)-1H-indol-4-amine
CID 151335762
N-[2-chloro-4-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 43714555
N-(2-chloro-4-methylphenyl)-1-methylazepan-4-amine
CID 65071149
4-chloro-N-(1-methylpiperidin-4-yl)pyridin-3-amine
CID 83166896
N-(2-chloro-4-fluorophenyl)-1-methylazepan-4-amine
CID 65071350
N-[2-fluoro-5-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 55144195
N-(2,4-dibromophenyl)-1-methylpiperidin-4-amine
CID 43683065
7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine
CID 57199203

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine?
The IUPAC name of 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine (CID 130361840) is 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine.
What is the SMILES notation for 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine?
The canonical SMILES for 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine is CN1CCC(Nc2cc(Cl)cc3[nH]ccc23)CC1.
What is the InChIKey of 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine?
The InChIKey is FTESINPVEGAGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3/c1-18-6-3-11(4-7-18)17-14-9-10(15)8-13-12(14)2-5-16-13/h2,5,8-9,11,16-17H,3-4,6-7H2,1H3.
What are the key properties of 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine?
6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine has a molecular weight of 263.77 g/mol, XLogP of 3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(1-methylpiperidin-4-yl)-1H-indol-4-amine is sourced from PubChem (CID 130361840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).