4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine

C8H11FN2 — CID 144606019

IUPAC4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine
SMILESC=C1C=C(C(F)CC)N=CN1
InChIInChI=1S/C8H11FN2/c1-3-7(9)8-4-6(2)10-5-11-8/h4-5,7H,2-3H2,1H3,(H,10,11)
InChIKeyUBDJQFNXJVJLKR-UHFFFAOYSA-N
MW154.19 g/mol
LogP1.76
Rot. Bonds2

About 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine

4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine (PubChem CID 144606019) has the molecular formula C8H11FN2 and a molecular weight of 154.19 g/mol. Its IUPAC name is 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine.

Molecular Properties

Compound Name4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine
PubChem CID144606019
Molecular FormulaC8H11FN2
Molecular Weight154.19 g/mol
Exact Mass154.09
IUPAC Name4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine
SMILESC=C1C=C(C(F)CC)N=CN1
InChIInChI=1S/C8H11FN2/c1-3-7(9)8-4-6(2)10-5-11-8/h4-5,7H,2-3H2,1H3,(H,10,11)
InChIKeyUBDJQFNXJVJLKR-UHFFFAOYSA-N
XLogP1.76
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3Z,5E)-8,8-difluoronona-3,5-dien-5-yl]-N'-methylmethanimidamide
CID 144415055
N-(2-ethenylcyclohexa-1,5-dien-1-yl)-N'-methylmethanimidamide
CID 129060116
N'-buta-1,3-dien-2-yl-N-[(3Z)-hexa-1,3-dien-2-yl]methanimidamide
CID 135208586
N-[(3Z)-hexa-1,3-dien-2-yl]-N'-methylmethanimidamide
CID 135243160
6-ethenyl-4-methyl-4-[(Z)-prop-1-enyl]-1H-pyrimidine
CID 137483320
N'-ethyl-N-[(3Z)-hexa-1,3-dien-2-yl]methanimidamide
CID 138528224
ethane;N-[(3Z)-3-ethyl-5-methylhexa-1,3,5-trien-2-yl]-N'-methylmethanimidamide
CID 143256830
4,6-dimethyl-1H-pyrimidin-4-ide;lawrencium
CID 145531779
N-[(3E)-hexa-3,5-dien-3-yl]-N'-methylmethanimidamide
CID 148226109
6-methylidene-4-propan-2-yl-1H-pyrimidine
CID 157212032
N-[(3Z)-hexa-1,3-dien-2-yl]-N'-[(Z)-pent-3-enyl]methanimidamide
CID 170254205
6-Propyl-1,4-dihydropyrimidine
CID 142130136

Frequently Asked Questions

What is the IUPAC name of 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine?
The IUPAC name of 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine (CID 144606019) is 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine.
What is the SMILES notation for 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine?
The canonical SMILES for 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine is C=C1C=C(C(F)CC)N=CN1.
What is the InChIKey of 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine?
The InChIKey is UBDJQFNXJVJLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2/c1-3-7(9)8-4-6(2)10-5-11-8/h4-5,7H,2-3H2,1H3,(H,10,11).
What are the key properties of 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine?
4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine has a molecular weight of 154.19 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluoropropyl)-6-methylidene-1H-pyrimidine is sourced from PubChem (CID 144606019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).