N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine

C17H17N3 — CID 105118515

IUPACN-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine
SMILESCNC(Cc1cccc2ccccc12)c1cncnc1
InChIInChI=1S/C17H17N3/c1-18-17(15-10-19-12-20-11-15)9-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,10-12,17-18H,9H2,1H3
InChIKeyCSTPRTWFJMGFOG-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.13
Rot. Bonds4

About N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine

N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine (PubChem CID 105118515) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine
PubChem CID105118515
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC NameN-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine
SMILESCNC(Cc1cccc2ccccc12)c1cncnc1
InChIInChI=1S/C17H17N3/c1-18-17(15-10-19-12-20-11-15)9-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,10-12,17-18H,9H2,1H3
InChIKeyCSTPRTWFJMGFOG-UHFFFAOYSA-N
XLogP3.13
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine 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

2-(2-bromophenyl)-N-methyl-1-pyrimidin-5-ylethanamine
CID 62829674
2-(1-benzothiophen-3-yl)-N-methyl-1-pyrimidin-5-ylethanamine
CID 102923329
1-(1,5-dimethylpyrazol-4-yl)-N-methyl-2-naphthalen-1-ylethanamine
CID 105131039
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
N-methyl-1-(1-methylpyrazol-3-yl)-2-naphthalen-1-ylethanamine
CID 65200268
[1-(5-bromo-3-pyridinyl)-2-naphthalen-1-ylethyl]hydrazine
CID 105251218
N-ethyl-1-pyrimidin-5-yl-2-quinolin-4-ylethanamine
CID 102923542
(2-naphthalen-1-yl-1-phenylethyl)hydrazine
CID 105199335
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
CID 102649497
N,4-dimethyl-3-(naphthalen-1-ylmethyl)pentan-2-amine
CID 62916002
[2-(2-bromophenyl)-1-pyrimidin-5-ylethyl]hydrazine
CID 105214865
N,2-dimethyl-3-naphthalen-1-ylpropan-1-amine
CID 62528877

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine?
The IUPAC name of N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine (CID 105118515) is N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine.
What is the SMILES notation for N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine?
The canonical SMILES for N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine is CNC(Cc1cccc2ccccc12)c1cncnc1.
What is the InChIKey of N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine?
The InChIKey is CSTPRTWFJMGFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-18-17(15-10-19-12-20-11-15)9-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,10-12,17-18H,9H2,1H3.
What are the key properties of N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine?
N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine has a molecular weight of 263.34 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine is sourced from PubChem (CID 105118515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).