N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine

C25H30N2O — CID 70645341

IUPACN,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine
SMILESCCCCC(c1cccc(-c2ccc(OCc3ccccc3)cc2)n1)N(C)C
InChIInChI=1S/C25H30N2O/c1-4-5-14-25(27(2)3)24-13-9-12-23(26-24)21-15-17-22(18-16-21)28-19-20-10-7-6-8-11-20/h6-13,15-18,25H,4-5,14,19H2,1-3H3
InChIKeyIKWGIDJQNFEVET-UHFFFAOYSA-N
MW374.53 g/mol
LogP6.12
Rot. Bonds9

About N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine

N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine (PubChem CID 70645341) has the molecular formula C25H30N2O and a molecular weight of 374.53 g/mol. Its IUPAC name is N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine
PubChem CID70645341
Molecular FormulaC25H30N2O
Molecular Weight374.53 g/mol
Exact Mass374.24
IUPAC NameN,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine
SMILESCCCCC(c1cccc(-c2ccc(OCc3ccccc3)cc2)n1)N(C)C
InChIInChI=1S/C25H30N2O/c1-4-5-14-25(27(2)3)24-13-9-12-23(26-24)21-15-17-22(18-16-21)28-19-20-10-7-6-8-11-20/h6-13,15-18,25H,4-5,14,19H2,1-3H3
InChIKeyIKWGIDJQNFEVET-UHFFFAOYSA-N
XLogP6.12
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.53
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-1-(6-phenyl-2-pyridinyl)pentan-1-amine
CID 70948630
3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine
CID 18923794
N-hydroxy-6-(4-phenylmethoxyphenyl)pyridine-2-carboxamide
CID 87562744
phenoxymethylbenzene;tetradecane
CID 175006528
2-methyl-4-(4-phenylmethoxyphenyl)-1,3-thiazole
CID 132533720
6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine
CID 166873727
N,N-dimethyl-4-(4-phenylmethoxyphenyl)butan-2-amine
CID 19885180
2-[[6-(4-phenylmethoxyphenyl)pyrimidin-4-yl]amino]heptanoic acid
CID 142893994
1-(4-phenylmethoxyphenyl)hexan-1-ol
CID 65145694
2,6-bis(4-methoxyphenyl)-4-(4-phenylmethoxyphenyl)pyridine
CID 132564654
2-(6-octoxy-3-pyridinyl)-5-(4-phenylmethoxyphenyl)pyrazine
CID 22412778
1-(4-phenylmethoxyphenyl)heptadecan-1-ol
CID 139807758

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine?
The IUPAC name of N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine (CID 70645341) is N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine is CCCCC(c1cccc(-c2ccc(OCc3ccccc3)cc2)n1)N(C)C.
What is the InChIKey of N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine?
The InChIKey is IKWGIDJQNFEVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O/c1-4-5-14-25(27(2)3)24-13-9-12-23(26-24)21-15-17-22(18-16-21)28-19-20-10-7-6-8-11-20/h6-13,15-18,25H,4-5,14,19H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine?
N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine has a molecular weight of 374.53 g/mol, XLogP of 6.12, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine is sourced from PubChem (CID 70645341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).