N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine

C12H21N3 — CID 81248510

IUPACN-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
SMILESCCN(C)c1ccncc1CNC(C)C
InChIInChI=1S/C12H21N3/c1-5-15(4)12-6-7-13-8-11(12)9-14-10(2)3/h6-8,10,14H,5,9H2,1-4H3
InChIKeyDUEZNXYSMNFZLZ-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.04
Rot. Bonds5

About N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine

N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine (PubChem CID 81248510) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
PubChem CID81248510
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
SMILESCCN(C)c1ccncc1CNC(C)C
InChIInChI=1S/C12H21N3/c1-5-15(4)12-6-7-13-8-11(12)9-14-10(2)3/h6-8,10,14H,5,9H2,1-4H3
InChIKeyDUEZNXYSMNFZLZ-UHFFFAOYSA-N
XLogP2.04
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-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-cyclopentyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81248504
N-[(2-bromophenyl)methyl]-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81249514
N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81247407
N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43281572
N-(2-methylpropyl)-N-pentan-3-yl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81254476
N-(4-methoxyphenyl)-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81249525
N-cyclobutyl-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105074523
N-(cyclohexylmethyl)-3-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 81248305
N-methyl-4-[(propan-2-ylamino)methyl]-N-prop-2-enylpyridin-3-amine
CID 105074309
N-(4-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105073352
N-methyl-2-[(propan-2-ylamino)methyl]-N-(pyridin-3-ylmethyl)aniline
CID 43563622
5-bromo-N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43281562

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine?
The IUPAC name of N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine (CID 81248510) is N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine.
What is the SMILES notation for N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine?
The canonical SMILES for N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine is CCN(C)c1ccncc1CNC(C)C.
What is the InChIKey of N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine?
The InChIKey is DUEZNXYSMNFZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-5-15(4)12-6-7-13-8-11(12)9-14-10(2)3/h6-8,10,14H,5,9H2,1-4H3.
What are the key properties of N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine?
N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine is sourced from PubChem (CID 81248510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).