2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine

C19H26N2O — CID 151535069

IUPAC2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine
SMILESCc1cc(-c2ccncc2)ccc1OCC(C)(N)CC(C)C
InChIInChI=1S/C19H26N2O/c1-14(2)12-19(4,20)13-22-18-6-5-17(11-15(18)3)16-7-9-21-10-8-16/h5-11,14H,12-13,20H2,1-4H3
InChIKeyPXHFBZADTJXPBU-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.20
Rot. Bonds6

About 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine

2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine (PubChem CID 151535069) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine.

Molecular Properties

Compound Name2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine
PubChem CID151535069
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine
SMILESCc1cc(-c2ccncc2)ccc1OCC(C)(N)CC(C)C
InChIInChI=1S/C19H26N2O/c1-14(2)12-19(4,20)13-22-18-6-5-17(11-15(18)3)16-7-9-21-10-8-16/h5-11,14H,12-13,20H2,1-4H3
InChIKeyPXHFBZADTJXPBU-UHFFFAOYSA-N
XLogP4.20
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2,4-dimethyl-1-[2-methyl-4-[2-(trifluoromethyl)pyrimidin-4-yl]phenoxy]pentan-2-amine
CID 135390625
(2S)-1-(4-imidazo[1,2-b]pyridazin-3-yl-2-methylphenoxy)-2,4-dimethylpentan-2-amine
CID 135390366
1-[[2-(difluoromethyl)-6-pyridin-4-yl-3-pyridinyl]oxy]-2,4-dimethylpentan-2-amine
CID 145286468
4-[4-[(2S)-2-amino-2,4-dimethylpentoxy]-3-methylphenyl]-N-(oxolan-3-yl)pyridin-2-amine
CID 137459508
(2S)-2,4-dimethyl-1-(2-methyl-4-pyrazolo[1,5-a]pyrimidin-3-ylphenoxy)pentan-2-amine
CID 137472254
1-(2-chloro-4-pyridazin-4-ylphenoxy)-2,4-dimethylpentan-2-amine
CID 150312529
N-[4-[4-(2-amino-2,4-dimethylpentoxy)-3-methylphenyl]pyrimidin-2-yl]-1,3-thiazol-2-amine
CID 135284552
[4-[4-[(2S)-2-amino-2,4-dimethylpentoxy]-3-methylphenyl]pyrimidin-2-yl] N-methylcarbamate
CID 175068485
2,4-dimethyl-1-(2-methyl-4-pyrazolo[1,5-a]pyridin-3-ylphenoxy)pentan-2-amine
CID 137459432
(2S)-2,4-dimethyl-1-[2-methyl-4-(3-methyl-3,3a-dihydropyrazolo[1,5-a]pyrimidin-7-yl)phenoxy]pentan-2-amine
CID 145286199
2,4-dimethyl-1-[[7-(2-methyl-4-pyridinyl)-1,3-benzothiazol-4-yl]oxy]pentan-2-amine
CID 137459495
[4-[4-(2-amino-2,4-dimethylpentoxy)-3-chlorophenyl]-2-pyridinyl] carbamate
CID 118420360

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine?
The IUPAC name of 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine (CID 151535069) is 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine.
What is the SMILES notation for 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine?
The canonical SMILES for 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine is Cc1cc(-c2ccncc2)ccc1OCC(C)(N)CC(C)C.
What is the InChIKey of 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine?
The InChIKey is PXHFBZADTJXPBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-14(2)12-19(4,20)13-22-18-6-5-17(11-15(18)3)16-7-9-21-10-8-16/h5-11,14H,12-13,20H2,1-4H3.
What are the key properties of 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine?
2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine has a molecular weight of 298.43 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-(2-methyl-4-pyridin-4-ylphenoxy)pentan-2-amine is sourced from PubChem (CID 151535069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).