6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine

C18H25N3 — CID 79234624

IUPAC6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine
SMILESCCCCN(Cc1cccc(NCC)n1)c1ccccc1
InChIInChI=1S/C18H25N3/c1-3-5-14-21(17-11-7-6-8-12-17)15-16-10-9-13-18(20-16)19-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,19,20)
InChIKeyRXCNNDNUUHKXSE-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.32
Rot. Bonds8

About 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine

6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine (PubChem CID 79234624) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine
PubChem CID79234624
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine
SMILESCCCCN(Cc1cccc(NCC)n1)c1ccccc1
InChIInChI=1S/C18H25N3/c1-3-5-14-21(17-11-7-6-8-12-17)15-16-10-9-13-18(20-16)19-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,19,20)
InChIKeyRXCNNDNUUHKXSE-UHFFFAOYSA-N
XLogP4.32
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[(N-butylanilino)methyl]-N-ethylpyridin-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-butyl-N-[(6-chloro-2-pyridinyl)methyl]aniline
CID 79241318
6-[[butyl(cyclopropyl)amino]methyl]-N-ethylpyridin-2-amine
CID 79243992
N-ethyl-6-[[pentyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 79243292
N-ethyl-6-[[methyl(propyl)amino]methyl]pyridin-2-amine
CID 79243084
N-[[4-(aminomethyl)phenyl]methyl]-N-butylaniline
CID 64584404
6-[(dibutylamino)methyl]-N-methylpyridin-2-amine
CID 79243168
2-N-ethyl-6-N-methyl-6-N-phenylpyridine-2,6-diamine
CID 80767103
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794
6-[(N,4-dimethylanilino)methyl]-N-ethylpyridin-2-amine
CID 79243997
N-[[3-(aminomethyl)phenyl]methyl]-N-butylaniline
CID 64584405
N-[[2-(2-aminoethyl)-1,3-thiazol-4-yl]methyl]-N-butylaniline
CID 66386087
6-[[2-ethoxyethyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 81073763

Frequently Asked Questions

What is the IUPAC name of 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine (CID 79234624) is 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine is CCCCN(Cc1cccc(NCC)n1)c1ccccc1.
What is the InChIKey of 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine?
The InChIKey is RXCNNDNUUHKXSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-3-5-14-21(17-11-7-6-8-12-17)15-16-10-9-13-18(20-16)19-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,19,20).
What are the key properties of 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine?
6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine has a molecular weight of 283.42 g/mol, XLogP of 4.32, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(N-butylanilino)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 79234624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).