N-benzyl-2-propan-2-ylpyridin-4-amine

C15H18N2 — CID 176809987

IUPACN-benzyl-2-propan-2-ylpyridin-4-amine
SMILESCC(C)c1cc(NCc2ccccc2)ccn1
InChIInChI=1S/C15H18N2/c1-12(2)15-10-14(8-9-16-15)17-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,16,17)
InChIKeyXCPHQFZPKAPIOO-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.82
Rot. Bonds4

About N-benzyl-2-propan-2-ylpyridin-4-amine

N-benzyl-2-propan-2-ylpyridin-4-amine (PubChem CID 176809987) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-benzyl-2-propan-2-ylpyridin-4-amine.

Molecular Properties

Compound NameN-benzyl-2-propan-2-ylpyridin-4-amine
PubChem CID176809987
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-benzyl-2-propan-2-ylpyridin-4-amine
SMILESCC(C)c1cc(NCc2ccccc2)ccn1
InChIInChI=1S/C15H18N2/c1-12(2)15-10-14(8-9-16-15)17-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,16,17)
InChIKeyXCPHQFZPKAPIOO-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-(benzylamino)pyridine-2-carboxylate
CID 66008646
N-benzyl-2-propan-2-ylpyrimidin-4-amine
CID 164867803
4-phenyl-2-propan-2-ylpyridine
CID 59796805
N-benzyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 21355599
N-benzyl-2-[3-(3-phenyl-2-pyridinyl)-2-pyridinyl]pyridin-4-amine
CID 175335566
N-[[4-(anilinomethyl)phenyl]methyl]pyridin-4-amine
CID 167597738
CID 163931246
CID 163931246
4-(benzylamino)-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
CID 109209829
N-[(4-ethylphenyl)methyl]-2-fluoropyridin-4-amine
CID 106900550
N-benzyl-4-propan-2-yloxyaniline
CID 28969524
N-benzyl-2,3-di(propan-2-yl)-1-benzothiophen-5-amine
CID 58128823
N-benzyl-4-(ethylamino)pyridine-2-carboxamide
CID 55042680

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-propan-2-ylpyridin-4-amine?
The IUPAC name of N-benzyl-2-propan-2-ylpyridin-4-amine (CID 176809987) is N-benzyl-2-propan-2-ylpyridin-4-amine.
What is the SMILES notation for N-benzyl-2-propan-2-ylpyridin-4-amine?
The canonical SMILES for N-benzyl-2-propan-2-ylpyridin-4-amine is CC(C)c1cc(NCc2ccccc2)ccn1.
What is the InChIKey of N-benzyl-2-propan-2-ylpyridin-4-amine?
The InChIKey is XCPHQFZPKAPIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-12(2)15-10-14(8-9-16-15)17-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,16,17).
What are the key properties of N-benzyl-2-propan-2-ylpyridin-4-amine?
N-benzyl-2-propan-2-ylpyridin-4-amine has a molecular weight of 226.32 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-propan-2-ylpyridin-4-amine is sourced from PubChem (CID 176809987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).