N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane

C15H21N3O — CID 157374019

IUPACN-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane
SMILESC.COc1cc(C)cc(Nc2cccc(CN)c2)n1
InChIInChI=1S/C14H17N3O.CH4/c1-10-6-13(17-14(7-10)18-2)16-12-5-3-4-11(8-12)9-15;/h3-8H,9,15H2,1-2H3,(H,16,17);1H4
InChIKeyBKCKUJDJWZPRRQ-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.24
Rot. Bonds4

About N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane

N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane (PubChem CID 157374019) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane
PubChem CID157374019
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane
SMILESC.COc1cc(C)cc(Nc2cccc(CN)c2)n1
InChIInChI=1S/C14H17N3O.CH4/c1-10-6-13(17-14(7-10)18-2)16-12-5-3-4-11(8-12)9-15;/h3-8H,9,15H2,1-2H3,(H,16,17);1H4
InChIKeyBKCKUJDJWZPRRQ-UHFFFAOYSA-N
XLogP3.24
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethylphenyl)-6-methoxy-4-methylpyridin-2-amine
CID 20714452
N-[3-(aminomethyl)phenyl]-2,6-dimethylpyrimidin-4-amine
CID 63767610
3-(aminomethyl)-N-[3-(aminomethyl)phenyl]aniline
CID 174680323
methyl 2-[3-(aminomethyl)anilino]-6-methoxypyridine-3-carboxylate
CID 20714362
N-[[3-(aminomethyl)phenyl]methyl]-6-methoxypyridin-2-amine
CID 63589651
N-[3-(aminomethyl)phenyl]-5-bromo-4-methoxypyrimidin-2-amine
CID 106999908
N-[3-(chloromethyl)phenyl]-6-methoxypyrimidin-4-amine
CID 66318087
N-[3-(aminomethyl)phenyl]quinoxalin-2-amine
CID 63767788
4-N-[3-(methoxymethyl)phenyl]-6-methylpyrimidine-2,4-diamine
CID 112726133
4-N-(3-iodophenyl)-6-methoxypyrimidine-2,4-diamine
CID 114053114
N-[3-(aminomethyl)phenyl]-4,6-dichloro-1,3,5-triazin-2-amine
CID 170875456
2-N-[3-(aminomethyl)phenyl]-6-N-methylpyridine-2,3,6-triamine
CID 163443040

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane?
The IUPAC name of N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane (CID 157374019) is N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane is C.COc1cc(C)cc(Nc2cccc(CN)c2)n1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane?
The InChIKey is BKCKUJDJWZPRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O.CH4/c1-10-6-13(17-14(7-10)18-2)16-12-5-3-4-11(8-12)9-15;/h3-8H,9,15H2,1-2H3,(H,16,17);1H4.
What are the key properties of N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane?
N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane has a molecular weight of 259.35 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-6-methoxy-4-methylpyridin-2-amine;methane is sourced from PubChem (CID 157374019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).