2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine

C11H14N2 — CID 178072479

IUPAC2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine
SMILESC/C=C(/C)c1ncc(C2CC2)cn1
InChIInChI=1S/C11H14N2/c1-3-8(2)11-12-6-10(7-13-11)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3/b8-3-
InChIKeyKNFBHZLYOIMTAA-BAQGIRSFSA-N
MW174.25 g/mol
LogP2.78
Rot. Bonds2

About 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine

2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine (PubChem CID 178072479) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine.

Molecular Properties

Compound Name2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine
PubChem CID178072479
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine
SMILESC/C=C(/C)c1ncc(C2CC2)cn1
InChIInChI=1S/C11H14N2/c1-3-8(2)11-12-6-10(7-13-11)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3/b8-3-
InChIKeyKNFBHZLYOIMTAA-BAQGIRSFSA-N
XLogP2.78
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 5-[4-(2-methoxycarbonylpyrimidin-5-yl)cyclohexyl]pyrimidine-2-carboxylate
CID 170080455
2-[(E)-but-2-en-2-yl]-5-methylpyrimidine;2-chloro-5-methylpyrimidine;methane
CID 159251829
5-cyclopropyl-2-prop-1-en-2-ylpyridine
CID 176925984
3-[(E)-2-chloroprop-1-enyl]-5-cyclopropyl-2-methylpyridine
CID 139524308
(5-cyclopropyl-2-pyridinyl) acetate
CID 174713182
(Z)-2-(4-cyclopropyl-2-pyridinyl)prop-1-ene-1-thiol
CID 155095946
1-(5-cyclopropyl-2-methyl-3-pyridinyl)propan-2-one
CID 139524310
(5-cyclopropyl-2-pyridinyl)methanol
CID 67151090
N-[(5-cyclopropyl-2-pyridinyl)methyl]ethanamine
CID 163383215
(2S,6R)-4-(5-cyclopropylpyrimidin-2-yl)-2,6-dimethylpiperazine-1-carboxylic acid
CID 170155927
5-cyclopropylpyridin-2-amine
CID 23004869
2,3-dibromo-5-cyclopropylpyridine
CID 130053485

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine?
The IUPAC name of 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine (CID 178072479) is 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine.
What is the SMILES notation for 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine?
The canonical SMILES for 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine is C/C=C(/C)c1ncc(C2CC2)cn1.
What is the InChIKey of 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine?
The InChIKey is KNFBHZLYOIMTAA-BAQGIRSFSA-N. The full InChI is InChI=1S/C11H14N2/c1-3-8(2)11-12-6-10(7-13-11)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3/b8-3-.
What are the key properties of 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine?
2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine has a molecular weight of 174.25 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-but-2-en-2-yl]-5-cyclopropylpyrimidine is sourced from PubChem (CID 178072479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).