4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine

C14H19N5 — CID 50983388

IUPAC4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
SMILESCCNc1ccnc(N(C)CCc2ccccn2)n1
InChIInChI=1S/C14H19N5/c1-3-15-13-7-10-17-14(18-13)19(2)11-8-12-6-4-5-9-16-12/h4-7,9-10H,3,8,11H2,1-2H3,(H,15,17,18)
InChIKeyKWPFHTIREDCOKN-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.98
Rot. Bonds6

About 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine

4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine (PubChem CID 50983388) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
PubChem CID50983388
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
SMILESCCNc1ccnc(N(C)CCc2ccccn2)n1
InChIInChI=1S/C14H19N5/c1-3-15-13-7-10-17-14(18-13)19(2)11-8-12-6-4-5-9-16-12/h4-7,9-10H,3,8,11H2,1-2H3,(H,15,17,18)
InChIKeyKWPFHTIREDCOKN-UHFFFAOYSA-N
XLogP1.98
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,2-N-dimethyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 64829086
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794
(2S)-N-(cyanomethyl)-4-methyl-2-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyrimidin-4-yl]amino]pentanamide
CID 10452450
6-ethoxy-2-N,4-N-dimethyl-2-N-(2-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80749975
6-bromo-N-methyl-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 63960883
4-N-methyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80765765
6-hydrazinyl-N-methyl-2-propyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80944141
2-N-butyl-2-N-methyl-4-N-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 112899258
N-methyl-5-phenyl-N-(2-pyridin-2-ylethyl)-1,2,4-oxadiazol-3-amine
CID 133481473
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
2-N,6-dimethyl-2-N-(2-pyridin-4-ylethyl)-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112919102
6-N-ethyl-2-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80938770

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine?
The IUPAC name of 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine (CID 50983388) is 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine is CCNc1ccnc(N(C)CCc2ccccn2)n1.
What is the InChIKey of 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine?
The InChIKey is KWPFHTIREDCOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-3-15-13-7-10-17-14(18-13)19(2)11-8-12-6-4-5-9-16-12/h4-7,9-10H,3,8,11H2,1-2H3,(H,15,17,18).
What are the key properties of 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine?
4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine has a molecular weight of 257.34 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 50983388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).