5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine

C10H15N3 — CID 143800882

IUPAC5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine
SMILESC=CC1=C(/C=C\C)N(C)C(N)=NC1
InChIInChI=1S/C10H15N3/c1-4-6-9-8(5-2)7-12-10(11)13(9)3/h4-6H,2,7H2,1,3H3,(H2,11,12)/b6-4-
InChIKeyQYTNEWBJVRKNFM-XQRVVYSFSA-N
MW177.25 g/mol
LogP1.26
Rot. Bonds2

About 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine

5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine (PubChem CID 143800882) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine.

Molecular Properties

Compound Name5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine
PubChem CID143800882
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine
SMILESC=CC1=C(/C=C\C)N(C)C(N)=NC1
InChIInChI=1S/C10H15N3/c1-4-6-9-8(5-2)7-12-10(11)13(9)3/h4-6H,2,7H2,1,3H3,(H2,11,12)/b6-4-
InChIKeyQYTNEWBJVRKNFM-XQRVVYSFSA-N
XLogP1.26
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine?
The IUPAC name of 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine (CID 143800882) is 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine.
What is the SMILES notation for 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine?
The canonical SMILES for 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine is C=CC1=C(/C=C\C)N(C)C(N)=NC1.
What is the InChIKey of 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine?
The InChIKey is QYTNEWBJVRKNFM-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H15N3/c1-4-6-9-8(5-2)7-12-10(11)13(9)3/h4-6H,2,7H2,1,3H3,(H2,11,12)/b6-4-.
What are the key properties of 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine?
5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine has a molecular weight of 177.25 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1-methyl-6-[(Z)-prop-1-enyl]-4H-pyrimidin-2-amine is sourced from PubChem (CID 143800882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).