2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine

C9H15N3 — CID 123146557

IUPAC2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine
SMILESCN(C)C1C=CNC(C2CC2)=N1
InChIInChI=1S/C9H15N3/c1-12(2)8-5-6-10-9(11-8)7-3-4-7/h5-8H,3-4H2,1-2H3,(H,10,11)
InChIKeyVYCNDYCSOONGQN-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.80
Rot. Bonds2

About 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine

2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine (PubChem CID 123146557) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine
PubChem CID123146557
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine
SMILESCN(C)C1C=CNC(C2CC2)=N1
InChIInChI=1S/C9H15N3/c1-12(2)8-5-6-10-9(11-8)7-3-4-7/h5-8H,3-4H2,1-2H3,(H,10,11)
InChIKeyVYCNDYCSOONGQN-UHFFFAOYSA-N
XLogP0.80
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine (CID 123146557) is 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine is CN(C)C1C=CNC(C2CC2)=N1.
What is the InChIKey of 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine?
The InChIKey is VYCNDYCSOONGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-12(2)8-5-6-10-9(11-8)7-3-4-7/h5-8H,3-4H2,1-2H3,(H,10,11).
What are the key properties of 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine?
2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine has a molecular weight of 165.24 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N,N-dimethyl-1,4-dihydropyrimidin-4-amine is sourced from PubChem (CID 123146557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).