N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine

C17H22N2O — CID 106900068

IUPACN-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
SMILESCCc1ccc(CNc2ncccc2OC(C)C)cc1
InChIInChI=1S/C17H22N2O/c1-4-14-7-9-15(10-8-14)12-19-17-16(20-13(2)3)6-5-11-18-17/h5-11,13H,4,12H2,1-3H3,(H,18,19)
InChIKeyMKRDCSPZIVLBPD-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.04
Rot. Bonds6

About N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine

N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine (PubChem CID 106900068) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
PubChem CID106900068
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
SMILESCCc1ccc(CNc2ncccc2OC(C)C)cc1
InChIInChI=1S/C17H22N2O/c1-4-14-7-9-15(10-8-14)12-19-17-16(20-13(2)3)6-5-11-18-17/h5-11,13H,4,12H2,1-3H3,(H,18,19)
InChIKeyMKRDCSPZIVLBPD-UHFFFAOYSA-N
XLogP4.04
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-ethylphenyl)methyl]-3-methoxypyridin-2-amine
CID 103872142
N-[(4-ethylphenyl)methyl]-3-propoxypyridin-2-amine
CID 106900046
N-[(3-fluorophenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 112547893
N-[(4-ethylphenyl)methyl]-3-methylpyridin-2-amine
CID 82679621
N-(3-methyl-2-propan-2-ylbutyl)-3-propan-2-yloxypyridin-2-amine
CID 102914136
3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 113450392
3-ethyl-1-[(3-propan-2-yloxy-2-pyridinyl)amino]pentan-2-ol
CID 106287839
1-N-(3-propan-2-yloxy-2-pyridinyl)pentane-1,4-diamine
CID 106127389
N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
CID 113370845
N-[(4-bromophenyl)methyl]-3-methoxypyridin-2-amine
CID 112547909
3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
CID 114169605
4-[[(3-propoxy-2-pyridinyl)amino]methyl]phenol
CID 114332578

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The IUPAC name of N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine (CID 106900068) is N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine is CCc1ccc(CNc2ncccc2OC(C)C)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The InChIKey is MKRDCSPZIVLBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-14-7-9-15(10-8-14)12-19-17-16(20-13(2)3)6-5-11-18-17/h5-11,13H,4,12H2,1-3H3,(H,18,19).
What are the key properties of N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine?
N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine is sourced from PubChem (CID 106900068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).