(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine

C15H18N2O — CID 174880823

IUPAC(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine
SMILESCC(C)Oc1ccc(CN)c(-c2ccccn2)c1
InChIInChI=1S/C15H18N2O/c1-11(2)18-13-7-6-12(10-16)14(9-13)15-5-3-4-8-17-15/h3-9,11H,10,16H2,1-2H3
InChIKeyCZVBFJXZOQZMQV-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.99
Rot. Bonds4

About (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine

(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine (PubChem CID 174880823) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine.

Molecular Properties

Compound Name(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine
PubChem CID174880823
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine
SMILESCC(C)Oc1ccc(CN)c(-c2ccccn2)c1
InChIInChI=1S/C15H18N2O/c1-11(2)18-13-7-6-12(10-16)14(9-13)15-5-3-4-8-17-15/h3-9,11H,10,16H2,1-2H3
InChIKeyCZVBFJXZOQZMQV-UHFFFAOYSA-N
XLogP2.99
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-propan-2-yloxyphenyl)pyridine
CID 70320352
[2-(4-propan-2-yloxyphenyl)-3-pyridinyl]methanamine
CID 117001852
2-(3-propan-2-yloxy-4-pyridin-2-ylphenyl)acetic acid
CID 139894117
[2-(2-chloro-5-fluorophenyl)-4-propan-2-yloxyphenyl]methanamine;hydrochloride
CID 172653793
2-[(2-chloro-4-propan-2-yloxyphenoxy)methyl]pyridine
CID 137421499
2-[2-[1-(4-fluorophenoxy)ethyl]phenyl]pyridine
CID 122364193
(4-methoxy-3-pyridin-2-ylphenyl)methanamine
CID 82508814
2-[2-(4-propan-2-yloxyphenoxy)ethoxy]pyridine
CID 15764663
(5S)-5-(4-methoxy-2-pyridin-2-ylphenyl)hexan-3-one
CID 162400292
5-methoxy-2-pyridin-2-ylpyridine
CID 604153
1-(4-propan-2-yloxyphenyl)-N-(pyridin-2-ylmethyl)ethanamine
CID 43195697
1-(2-chloro-4-propan-2-yloxyphenyl)-3-(pyridin-2-ylmethyl)urea
CID 99823700

Frequently Asked Questions

What is the IUPAC name of (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine?
The IUPAC name of (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine (CID 174880823) is (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine.
What is the SMILES notation for (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine?
The canonical SMILES for (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine is CC(C)Oc1ccc(CN)c(-c2ccccn2)c1.
What is the InChIKey of (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine?
The InChIKey is CZVBFJXZOQZMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11(2)18-13-7-6-12(10-16)14(9-13)15-5-3-4-8-17-15/h3-9,11H,10,16H2,1-2H3.
What are the key properties of (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine?
(4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propan-2-yloxy-2-pyridin-2-ylphenyl)methanamine is sourced from PubChem (CID 174880823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).