6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine

C16H22N4 — CID 97437078

IUPAC6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine
SMILESC[C@H](c1cccc(-c2ccc(N(C)C)nn2)c1)N(C)C
InChIInChI=1S/C16H22N4/c1-12(19(2)3)13-7-6-8-14(11-13)15-9-10-16(18-17-15)20(4)5/h6-12H,1-5H3/t12-/m1/s1
InChIKeyKKFVVKPFBKCQAY-GFCCVEGCSA-N
MW270.38 g/mol
LogP2.83
Rot. Bonds4

About 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine

6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine (PubChem CID 97437078) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine
PubChem CID97437078
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine
SMILESC[C@H](c1cccc(-c2ccc(N(C)C)nn2)c1)N(C)C
InChIInChI=1S/C16H22N4/c1-12(19(2)3)13-7-6-8-14(11-13)15-9-10-16(18-17-15)20(4)5/h6-12H,1-5H3/t12-/m1/s1
InChIKeyKKFVVKPFBKCQAY-GFCCVEGCSA-N
XLogP2.83
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-[(1S)-1-(dimethylamino)ethyl]phenyl]pyrimidin-2-amine
CID 39820225
2-N-[6-(3-fluorophenyl)pyridazin-3-yl]-2-N-methylpropane-1,2-diamine
CID 116973366
3-[(1R)-1-(dimethylamino)ethyl]phenol
CID 10313270
3-[3-[(1S)-1-methoxyethyl]phenyl]-6-propan-2-ylpyridazine
CID 126446276
N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine
CID 119062682
4-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]thiophene-2-carboxamide
CID 97436517
(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
N'-methyl-N'-[6-(3-methylphenyl)pyridazin-3-yl]ethane-1,2-diamine
CID 116973263
N,N-dimethyl-1-[4-[3-(4-methylphenyl)phenyl]phenyl]ethanamine
CID 176844066
5-[3-[1-(dimethylamino)ethyl]phenyl]-2,3-dihydroinden-1-one
CID 50966477
(1S)-N,N-dimethyl-1-phenylethanamine;hydrochloride
CID 141121906
3-[3-[(1S)-1-(dimethylamino)ethyl]phenyl]-4-methylbenzoic acid
CID 95230720

Frequently Asked Questions

What is the IUPAC name of 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine?
The IUPAC name of 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine (CID 97437078) is 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine?
The canonical SMILES for 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine is C[C@H](c1cccc(-c2ccc(N(C)C)nn2)c1)N(C)C.
What is the InChIKey of 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine?
The InChIKey is KKFVVKPFBKCQAY-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H22N4/c1-12(19(2)3)13-7-6-8-14(11-13)15-9-10-16(18-17-15)20(4)5/h6-12H,1-5H3/t12-/m1/s1.
What are the key properties of 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine?
6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine has a molecular weight of 270.38 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-[(1R)-1-(dimethylamino)ethyl]phenyl]-N,N-dimethylpyridazin-3-amine is sourced from PubChem (CID 97437078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).