N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride

C14H19ClN2 — CID 21393596

IUPACN,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride
SMILESCN(C)C1=CC2=C(CC1)N=C1CCCC=C12.Cl
InChIInChI=1S/C14H18N2.ClH/c1-16(2)10-7-8-14-12(9-10)11-5-3-4-6-13(11)15-14;/h5,9H,3-4,6-8H2,1-2H3;1H
InChIKeyAHNUKTBIDBBSBD-UHFFFAOYSA-N
MW250.77 g/mol
LogP3.47
Rot. Bonds1

About N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride

N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride (PubChem CID 21393596) has the molecular formula C14H19ClN2 and a molecular weight of 250.77 g/mol. Its IUPAC name is N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride
PubChem CID21393596
Molecular FormulaC14H19ClN2
Molecular Weight250.77 g/mol
Exact Mass250.12
IUPAC NameN,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride
SMILESCN(C)C1=CC2=C(CC1)N=C1CCCC=C12.Cl
InChIInChI=1S/C14H18N2.ClH/c1-16(2)10-7-8-14-12(9-10)11-5-3-4-6-13(11)15-14;/h5,9H,3-4,6-8H2,1-2H3;1H
InChIKeyAHNUKTBIDBBSBD-UHFFFAOYSA-N
XLogP3.47
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride?
The IUPAC name of N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride (CID 21393596) is N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride?
The canonical SMILES for N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride is CN(C)C1=CC2=C(CC1)N=C1CCCC=C12.Cl.
What is the InChIKey of N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride?
The InChIKey is AHNUKTBIDBBSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2.ClH/c1-16(2)10-7-8-14-12(9-10)11-5-3-4-6-13(11)15-14;/h5,9H,3-4,6-8H2,1-2H3;1H.
What are the key properties of N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride?
N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride has a molecular weight of 250.77 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,6,7,8-tetrahydro-1H-carbazol-3-amine;hydrochloride is sourced from PubChem (CID 21393596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).