N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine

C16H20N2O — CID 133271435

IUPACN-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine
SMILESCC(C)COc1ccccc1CNc1ccccn1
InChIInChI=1S/C16H20N2O/c1-13(2)12-19-15-8-4-3-7-14(15)11-18-16-9-5-6-10-17-16/h3-10,13H,11-12H2,1-2H3,(H,17,18)
InChIKeyPZUSIZLJRLKEHQ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.73
Rot. Bonds6

About N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine

N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine (PubChem CID 133271435) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine
PubChem CID133271435
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine
SMILESCC(C)COc1ccccc1CNc1ccccn1
InChIInChI=1S/C16H20N2O/c1-13(2)12-19-15-8-4-3-7-14(15)11-18-16-9-5-6-10-17-16/h3-10,13H,11-12H2,1-2H3,(H,17,18)
InChIKeyPZUSIZLJRLKEHQ-UHFFFAOYSA-N
XLogP3.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethylphenyl)methyl]pyridin-2-amine
CID 64695521
2,4,6-trimethyl-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 39418717
4-ethyl-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 39384019
N-[[2-(3-methylbutoxy)phenyl]methyl]-2-(2-methylpropoxy)aniline
CID 54800105
N-[(2-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 115692595
2-(2-methylpropoxy)-N-(pyridin-2-ylmethyl)aniline
CID 54864900
1-[[2-(2-methylpropoxy)phenyl]methyl]-2-phenylhydrazine
CID 169385411
2,4-dichloro-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 54795837
1-(2-methylpropoxy)-2-[2-[2-[2-(2-methylpropoxy)phenyl]ethoxy]ethyl]benzene
CID 141096920
N-[(2-ethylphenyl)methyl]-2-(2-methylpropoxy)aniline
CID 63453225
N-[[2-(2-methylpropoxy)phenyl]methyl]butan-1-amine
CID 54797416
2-methoxy-5-methyl-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 39422604

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine?
The IUPAC name of N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine (CID 133271435) is N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine.
What is the SMILES notation for N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine?
The canonical SMILES for N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine is CC(C)COc1ccccc1CNc1ccccn1.
What is the InChIKey of N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine?
The InChIKey is PZUSIZLJRLKEHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-13(2)12-19-15-8-4-3-7-14(15)11-18-16-9-5-6-10-17-16/h3-10,13H,11-12H2,1-2H3,(H,17,18).
What are the key properties of N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine?
N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine is sourced from PubChem (CID 133271435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).