N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide

C10H16N4O — CID 103111508

IUPACN-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide
SMILESCCN(C)C(=O)C(C)Nc1ccncn1
InChIInChI=1S/C10H16N4O/c1-4-14(3)10(15)8(2)13-9-5-6-11-7-12-9/h5-8H,4H2,1-3H3,(H,11,12,13)
InChIKeyKAXWMZTZRRUBMJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.76
Rot. Bonds4

About N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide

N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide (PubChem CID 103111508) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide
PubChem CID103111508
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide
SMILESCCN(C)C(=O)C(C)Nc1ccncn1
InChIInChI=1S/C10H16N4O/c1-4-14(3)10(15)8(2)13-9-5-6-11-7-12-9/h5-8H,4H2,1-3H3,(H,11,12,13)
InChIKeyKAXWMZTZRRUBMJ-UHFFFAOYSA-N
XLogP0.76
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide?
The IUPAC name of N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide (CID 103111508) is N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide is CCN(C)C(=O)C(C)Nc1ccncn1.
What is the InChIKey of N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide?
The InChIKey is KAXWMZTZRRUBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-4-14(3)10(15)8(2)13-9-5-6-11-7-12-9/h5-8H,4H2,1-3H3,(H,11,12,13).
What are the key properties of N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide?
N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide has a molecular weight of 208.26 g/mol, XLogP of 0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(pyrimidin-4-ylamino)propanamide is sourced from PubChem (CID 103111508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).