(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine

C17H22N2O — CID 118928757

IUPAC(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine
SMILESCC(C)[C@H](c1ccc(Oc2ccccn2)cc1)N(C)C
InChIInChI=1S/C17H22N2O/c1-13(2)17(19(3)4)14-8-10-15(11-9-14)20-16-7-5-6-12-18-16/h5-13,17H,1-4H3/t17-/m1/s1
InChIKeyBBHBBVJRDZJNKZ-QGZVFWFLSA-N
MW270.38 g/mol
LogP4.13
Rot. Bonds5

About (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine

(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine (PubChem CID 118928757) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine
PubChem CID118928757
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine
SMILESCC(C)[C@H](c1ccc(Oc2ccccn2)cc1)N(C)C
InChIInChI=1S/C17H22N2O/c1-13(2)17(19(3)4)14-8-10-15(11-9-14)20-16-7-5-6-12-18-16/h5-13,17H,1-4H3/t17-/m1/s1
InChIKeyBBHBBVJRDZJNKZ-QGZVFWFLSA-N
XLogP4.13
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,2S)-1-N,1-N-dimethyl-2-N-propan-2-yl-1-(4-pyridin-2-yloxyphenyl)propane-1,2-diamine
CID 130466001
4-[(2R)-butan-2-yl]-N-methyl-N-(4-pyridin-2-yloxyphenyl)aniline
CID 118954610
ethane;2-phenoxypyridine
CID 90835857
N-(4-propan-2-ylphenyl)-N-(4-pyridin-2-yloxyphenyl)oxolan-3-amine
CID 118954586
(4-pyridin-2-yloxyphenyl)hydrazine
CID 69019793
(1R)-1-[4-(cyclopropylmethoxy)phenyl]-N,N,2-trimethylpropan-1-amine
CID 118928761
2-[3-chloro-4-(6-propan-2-ylnaphthalen-2-yl)oxyphenoxy]pyridine
CID 91366744
2-methyl-N-[(4-pyridin-2-yloxyphenyl)methyl]propan-2-amine
CID 71120055
8-[[1-[4-(benzenesulfonyl)phenyl]-1-(dimethylamino)propan-2-yl]amino]-6-methylpyrido[2,3-d]pyridazin-5-one;4-[[(1S,2S)-1-[4-(cyclopropylmethoxy)phenyl]-1-(dimethylamino)propan-2-yl]amino]-2-methylphthalazin-1-one;4-[[(1S,2S)-1-(dimethylamino)-1-(4-phenoxyphenyl)propan-2-yl]amino]-2-methylphthalazin-1-one;4-[[(1S,2S)-1-(dimethylamino)-1-(4-pyridin-2-yloxyphenyl)propan-2-yl]amino]-2-methylphthalazin-1-one
CID 161304956
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]pyridine
CID 67248701
2-(4-piperidin-1-ium-4-ylphenoxy)pyridine chloride
CID 177057884
N-hydroxyethanimidoyl chloride;2-phenoxypyridine
CID 86612460

Frequently Asked Questions

What is the IUPAC name of (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine?
The IUPAC name of (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine (CID 118928757) is (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine.
What is the SMILES notation for (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine?
The canonical SMILES for (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine is CC(C)[C@H](c1ccc(Oc2ccccn2)cc1)N(C)C.
What is the InChIKey of (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine?
The InChIKey is BBHBBVJRDZJNKZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13(2)17(19(3)4)14-8-10-15(11-9-14)20-16-7-5-6-12-18-16/h5-13,17H,1-4H3/t17-/m1/s1.
What are the key properties of (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine?
(1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine has a molecular weight of 270.38 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N,N,2-trimethyl-1-(4-pyridin-2-yloxyphenyl)propan-1-amine is sourced from PubChem (CID 118928757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).