N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine

C18H24N2 — CID 62321412

IUPACN-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
SMILESCc1cccc(CNC(C)c2ccc(C(C)C)cc2)n1
InChIInChI=1S/C18H24N2/c1-13(2)16-8-10-17(11-9-16)15(4)19-12-18-7-5-6-14(3)20-18/h5-11,13,15,19H,12H2,1-4H3
InChIKeyHNFJBKICBXBCOP-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.36
Rot. Bonds5

About N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine

N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine (PubChem CID 62321412) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound NameN-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
PubChem CID62321412
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
SMILESCc1cccc(CNC(C)c2ccc(C(C)C)cc2)n1
InChIInChI=1S/C18H24N2/c1-13(2)16-8-10-17(11-9-16)15(4)19-12-18-7-5-6-14(3)20-18/h5-11,13,15,19H,12H2,1-4H3
InChIKeyHNFJBKICBXBCOP-UHFFFAOYSA-N
XLogP4.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(4-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 81347820
1-(4-methoxyphenyl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 55056902
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-4-ylethanamine
CID 62321260
1-(4-chloro-3-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 82994274
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylethanamine
CID 62321588
3,3-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
CID 115710700
N-methyl-4-[1-[(6-propan-2-yl-2-pyridinyl)methylamino]ethyl]benzenesulfonamide
CID 75471678
1-N,1-N-dimethyl-2-N-[(6-methyl-2-pyridinyl)methyl]propane-1,2-diamine
CID 82939144
1-(3-bromothiophen-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 55057431
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
1-(4-bromophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
CID 62321246
4-[1-[(6-methyl-2-pyridinyl)methylamino]propyl]phenol
CID 62321765

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine (CID 62321412) is N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine is Cc1cccc(CNC(C)c2ccc(C(C)C)cc2)n1.
What is the InChIKey of N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is HNFJBKICBXBCOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-13(2)16-8-10-17(11-9-16)15(4)19-12-18-7-5-6-14(3)20-18/h5-11,13,15,19H,12H2,1-4H3.
What are the key properties of N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine?
N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 268.40 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 62321412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).