N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine

C16H23ClN2 — CID 81343630

IUPACN-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine
SMILESCC1CC(NC2Cc3ccc(Cl)cc3C2)CCN1C
InChIInChI=1S/C16H23ClN2/c1-11-7-15(5-6-19(11)2)18-16-9-12-3-4-14(17)8-13(12)10-16/h3-4,8,11,15-16,18H,5-7,9-10H2,1-2H3
InChIKeyHAHRXDRRSODJHH-UHFFFAOYSA-N
MW278.83 g/mol
LogP2.88
Rot. Bonds2

About N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine

N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine (PubChem CID 81343630) has the molecular formula C16H23ClN2 and a molecular weight of 278.83 g/mol. Its IUPAC name is N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine
PubChem CID81343630
Molecular FormulaC16H23ClN2
Molecular Weight278.83 g/mol
Exact Mass278.15
IUPAC NameN-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine
SMILESCC1CC(NC2Cc3ccc(Cl)cc3C2)CCN1C
InChIInChI=1S/C16H23ClN2/c1-11-7-15(5-6-19(11)2)18-16-9-12-3-4-14(17)8-13(12)10-16/h3-4,8,11,15-16,18H,5-7,9-10H2,1-2H3
InChIKeyHAHRXDRRSODJHH-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.83
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1-methylpiperidin-4-amine
CID 81300742
3-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]cyclohexan-1-ol
CID 81328885
5-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-1-methylpiperidin-2-one
CID 81339258
4-chloro-2-[[(1,2-dimethylpiperidin-4-yl)amino]methyl]phenol
CID 79032255
4-chloro-2-[(1,2-dimethylpiperidin-4-yl)amino]benzonitrile
CID 79033920
5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine
CID 115348993
N-[1-(2,4-dichlorophenyl)propyl]-1,2-dimethylpiperidin-4-amine
CID 81342935
5-chloro-N-(3-ethyl-2-methylcyclopentyl)-2,3-dihydro-1H-inden-2-amine
CID 115349079
4-chloro-N-(1,2-dimethylpiperidin-4-yl)pyridine-2-carboxamide
CID 79005580
(2R,4S)-N,1,2-trimethylpiperidin-4-amine
CID 94244018
(2S,4R)-N,1,2-trimethylpiperidin-4-amine
CID 94244017
N-(6,8-dichloro-3,4-dihydro-2H-chromen-4-yl)-1,2-dimethylpiperidin-4-amine
CID 81345378

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine?
The IUPAC name of N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine (CID 81343630) is N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine?
The canonical SMILES for N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine is CC1CC(NC2Cc3ccc(Cl)cc3C2)CCN1C.
What is the InChIKey of N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine?
The InChIKey is HAHRXDRRSODJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2/c1-11-7-15(5-6-19(11)2)18-16-9-12-3-4-14(17)8-13(12)10-16/h3-4,8,11,15-16,18H,5-7,9-10H2,1-2H3.
What are the key properties of N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine?
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine has a molecular weight of 278.83 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 81343630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).