N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine

C15H25N3 — CID 62279989

IUPACN-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESC=C(C)CN(CC)c1cccc(CNC(C)C)n1
InChIInChI=1S/C15H25N3/c1-6-18(11-12(2)3)15-9-7-8-14(17-15)10-16-13(4)5/h7-9,13,16H,2,6,10-11H2,1,3-5H3
InChIKeyJENALMRQNGASAV-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.98
Rot. Bonds7

About N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine

N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine (PubChem CID 62279989) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
PubChem CID62279989
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESC=C(C)CN(CC)c1cccc(CNC(C)C)n1
InChIInChI=1S/C15H25N3/c1-6-18(11-12(2)3)15-9-7-8-14(17-15)10-16-13(4)5/h7-9,13,16H,2,6,10-11H2,1,3-5H3
InChIKeyJENALMRQNGASAV-UHFFFAOYSA-N
XLogP2.98
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-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-ethyl-N-(2-methylprop-2-enyl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62279471
N-butan-2-yl-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62280724
2-[[6-(aminomethyl)-2-pyridinyl]-ethylamino]-N-propan-2-ylacetamide
CID 64589162
N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]propan-2-amine;dihydrobromide
CID 11545437
N-methyl-N-pentyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 55054776
N-ethyl-6-(methylaminomethyl)-N-propylpyridin-2-amine
CID 62280053
N-(cyclopropylmethyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62284019
N-methyl-6-[(propan-2-ylamino)methyl]-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 81075076
6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine
CID 66457774
2-[ethyl-[6-(methylamino)-2-pyridinyl]amino]-N-propan-2-ylacetamide
CID 80805603
N-[(4-fluorophenyl)methyl]-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62287465
N-[[6-[2-(diethylamino)ethoxy]-2-pyridinyl]methyl]propan-2-amine
CID 55058800

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine (CID 62279989) is N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine is C=C(C)CN(CC)c1cccc(CNC(C)C)n1.
What is the InChIKey of N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The InChIKey is JENALMRQNGASAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-6-18(11-12(2)3)15-9-7-8-14(17-15)10-16-13(4)5/h7-9,13,16H,2,6,10-11H2,1,3-5H3.
What are the key properties of N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylprop-2-enyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62279989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).