N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide

C10H16N4O — CID 62760933

IUPACN,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide
SMILESCC(NCc1ccncn1)C(=O)N(C)C
InChIInChI=1S/C10H16N4O/c1-8(10(15)14(2)3)12-6-9-4-5-11-7-13-9/h4-5,7-8,12H,6H2,1-3H3
InChIKeyJORXURSTJIVSFI-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.04
Rot. Bonds4

About N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide

N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide (PubChem CID 62760933) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide
PubChem CID62760933
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide
SMILESCC(NCc1ccncn1)C(=O)N(C)C
InChIInChI=1S/C10H16N4O/c1-8(10(15)14(2)3)12-6-9-4-5-11-7-13-9/h4-5,7-8,12H,6H2,1-3H3
InChIKeyJORXURSTJIVSFI-UHFFFAOYSA-N
XLogP0.04
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 ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide?
The IUPAC name of N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide (CID 62760933) is N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide.
What is the SMILES notation for N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide?
The canonical SMILES for N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide is CC(NCc1ccncn1)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide?
The InChIKey is JORXURSTJIVSFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-8(10(15)14(2)3)12-6-9-4-5-11-7-13-9/h4-5,7-8,12H,6H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide?
N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide has a molecular weight of 208.26 g/mol, XLogP of 0.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(pyrimidin-4-ylmethylamino)propanamide is sourced from PubChem (CID 62760933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).